Precision medicine for chronic diseases such as multiple sclerosis (MS) involves choosing a treatment which best balances efficacy and side effects/preferences for individual patients. Making this choice as early as possible is important, as delays in finding an effective therapy can lead to irreversible disability accrual. To this end, we present the first deep neural network model for individualized treatment decisions from baseline magnetic resonance imaging (MRI) (with clinical information if available) for MS patients. Our model (a) predicts future new and enlarging T2 weighted (NE-T2) lesion counts on follow-up MRI on multiple treatments and (b) estimates the conditional average treatment effect (CATE), as defined by the predicted future suppression of NE-T2 lesions, between different treatment options relative to placebo. Our model is validated on a proprietary federated dataset of 1817 multi-sequence MRIs acquired from MS patients during four multi-centre randomized clinical trials. Our framework achieves high average precision in the binarized regression of future NE-T2 lesions on five different treatments, identifies heterogeneous treatment effects, and provides a personalized treatment recommendation that accounts for treatment-associated risk (e.g. side effects, patient preference, administration difficulties).

Taking advantage of the many recent advances in deep learning, text-to-image generative models currently have the merit of attracting the general public attention. Two of these models, DALL-E 2 and Imagen, have demonstrated that highly photorealistic images could be generated from a simple textual description of an image. Based on a novel approach for image generation called diffusion models, text-to-image models enable the production of many different types of high resolution images, where human imagination is the only limit. However, these models require exceptionally large amounts of computational resources to train, as well as handling huge datasets collected from the internet. In addition, neither the codebase nor the models have been released. It consequently prevents the AI community from experimenting with these cutting-edge models, making the reproduction of their results complicated, if not impossible. In this thesis, we aim to contribute by firstly reviewing the different approaches and techniques used by these models, and then by proposing our own implementation of a text-to-image model. Highly based on DALL-E 2, we introduce several slight modifications to tackle the high computational cost induced. We thus have the opportunity to experiment in order to understand what these models are capable of, especially in a low resource regime. In particular, we provide additional and analyses deeper than the ones performed by the authors of DALL-E 2, including ablation studies. Besides, diffusion models use so-called guidance methods to help the generating process. We introduce a new guidance method which can be used in conjunction with other guidance methods to improve image quality. Finally, the images generated by our model are of reasonably good quality, without having to sustain the significant training costs of state-of-the-art text-to-image models.

Concept-based explanations permit to understand the predictions of a deep neural network (DNN) through the lens of concepts specified by users. Existing methods assume that the examples illustrating a concept are mapped in a fixed direction of the DNN's latent space. When this holds true, the concept can be represented by a concept activation vector (CAV) pointing in that direction. In this work, we propose to relax this assumption by allowing concept examples to be scattered across different clusters in the DNN's latent space. Each concept is then represented by a region of the DNN's latent space that includes these clusters and that we call concept activation region (CAR). To formalize this idea, we introduce an extension of the CAV formalism that is based on the kernel trick and support vector classifiers. This CAR formalism yields global concept-based explanations and local concept-based feature importance. We prove that CAR explanations built with radial kernels are invariant under latent space isometries. In this way, CAR assigns the same explanations to latent spaces that have the same geometry. We further demonstrate empirically that CARs offer (1) more accurate descriptions of how concepts are scattered in the DNN's latent space; (2) global explanations that are closer to human concept annotations and (3) concept-based feature importance that meaningfully relate concepts with each other. Finally, we use CARs to show that DNNs can autonomously rediscover known scientific concepts, such as the prostate cancer grading system.

Benchmarks for the evaluation of model performance play an important role in machine learning. However, there is no established way to describe and create new benchmarks. What is more, the most common benchmarks use performance measures that share several limitations. For example, the difference in performance for two models has no probabilistic interpretation, there is no reference point to indicate whether they represent a significant improvement, and it makes no sense to compare such differences between data sets. We introduce a new meta-score assessment named Elo-based Predictive Power (EPP) that is built on top of other performance measures and allows for interpretable comparisons of models. The differences in EPP scores have a probabilistic interpretation and can be directly compared between data sets, furthermore, the logistic regression-based design allows for an assessment of ranking fitness based on a deviance statistic. We prove the mathematical properties of EPP and support them with empirical results of a large scale benchmark on 30 classification data sets and a real-world benchmark for visual data. Additionally, we propose a Unified Benchmark Ontology that is used to give a uniform description of benchmarks.

Voice Activity Detection (VAD) aims at detecting speech segments on an audio signal, which is a necessary first step for many today's speech based applications. Current state-of-the-art methods focus on training a neural network exploiting features directly contained in the acoustics, such as Mel Filter Banks (MFBs). Such methods therefore require an extra normalisation step to adapt to a new domain where the acoustics is impacted, which can be simply due to a change of speaker, microphone, or environment. In addition, this normalisation step is usually a rather rudimentary method that has certain limitations, such as being highly susceptible to the amount of data available for the new domain. Here, we exploited the crowd-sourced Common Voice (CV) corpus to show that representations based on Self-Supervised Learning (SSL) can adapt well to different domains, because they are computed with contextualised representations of speech across multiple domains. SSL representations also achieve better results than systems based on hand-crafted representations (MFBs), and off-the-shelf VADs, with significant improvement in cross-domain settings.

Understanding black-box machine learning models is crucial for their widespread adoption. Learning globally interpretable models is one approach, but achieving high performance with them is challenging. An alternative approach is to explain individual predictions using locally interpretable models. For locally interpretable modeling, various methods have been proposed and indeed commonly used, but they suffer from low fidelity, i.e. their explanations do not approximate the predictions well. In this paper, our goal is to push the state-of-the-art in high-fidelity locally interpretable modeling. We propose a novel framework, Locally Interpretable Modeling using Instance-wise Subsampling (LIMIS). LIMIS utilizes a policy gradient to select a small number of instances and distills the black-box model into a low-capacity locally interpretable model using those selected instances. Training is guided with a reward obtained directly by measuring the fidelity of the locally interpretable models. We show on multiple tabular datasets that LIMIS near-matches the prediction accuracy of black-box models, significantly outperforming state-of-the-art locally interpretable models in terms of fidelity and prediction accuracy.

When dealing with tabular data, models based on regression and decision trees are a popular choice due to the high accuracy they provide on such tasks and their ease of application as compared to other model classes. Yet, when it comes to graph-structure data, current tree learning algorithms do not provide tools to manage the structure of the data other than relying on feature engineering. In this work we address the above gap, and introduce Graph Trees with Attention (GTA), a new family of tree-based learning algorithms that are designed to operate on graphs. GTA leverages both the graph structure and the features at the vertices and employs an attention mechanism that allows decisions to concentrate on sub-structures of the graph. We analyze GTA models and show that they are strictly more expressive than plain decision trees. We also demonstrate the benefits of GTA empirically on multiple graph and node prediction benchmarks. In these experiments, GTA always outperformed other tree-based models and often outperformed other types of graph-learning algorithms such as Graph Neural Networks (GNNs) and Graph Kernels. Finally, we also provide an explainability mechanism for GTA, and demonstrate it can provide intuitive explanations.

Performance optimization of deep learning models is conducted either manually or through automatic architecture search, or a combination of both. On the other hand, their performance strongly depends on the target hardware and how successfully the models were trained. We propose to use a multi-dimensional Pareto frontier to re-define the efficiency measure of candidate deep learning models, where several variables such as training cost, inference latency, and accuracy play a relative role in defining a dominant model. Furthermore, a random version of the multi-dimensional Pareto frontier is introduced to mitigate the uncertainty of accuracy, latency, and throughput of deep learning models in different experimental setups. These two complementary methods can be combined to perform objective benchmarking of deep learning models. Our proposed method is applied to a wide range of deep image classification models trained on ImageNet data. Our method combines competing variables with stochastic nature in a single relative efficiency measure. This allows ranking deep learning models that run efficiently on different hardware, and combining inference efficiency with training efficiency objectively.

Contextual bandit and reinforcement learning algorithms have been successfully used in various interactive learning systems such as online advertising, recommender systems, and dynamic pricing. However, they have yet to be widely adopted in high-stakes application domains, such as healthcare. One reason may be that existing approaches assume that the underlying mechanisms are static in the sense that they do not change over different environments. In many real-world systems, however, the mechanisms are subject to shifts across environments which may invalidate the static environment assumption. In this paper, we take a step toward tackling the problem of environmental shifts considering the framework of offline contextual bandits. We view the environmental shift problem through the lens of causality and propose multi-environment contextual bandits that allow for changes in the underlying mechanisms. We adopt the concept of invariance from the causality literature and introduce the notion of policy invariance. We argue that policy invariance is only relevant if unobserved variables are present and show that, in that case, an optimal invariant policy is guaranteed to generalize across environments under suitable assumptions. Our results establish concrete connections among causality, invariance, and contextual bandits.

Decentralized-SGD (D-SGD) distributes heavy learning tasks across multiple machines (a.k.a., {\em nodes}), effectively dividing the workload per node by the size of the system. However, a handful of \emph{Byzantine} (i.e., misbehaving) nodes can jeopardize the entire learning procedure. This vulnerability is further amplified when the system is \emph{asynchronous}. Although approaches that confer Byzantine resilience to D-SGD have been proposed, these significantly impact the efficiency of the process to the point of even negating the benefit of decentralization. This naturally raises the question: \emph{can decentralized learning simultaneously enjoy Byzantine resilience and reduced workload per node?} We answer positively by proposing \newalgorithm{} that ensures Byzantine resilience without losing the computational efficiency of D-SGD. Essentially, \newalgorithm{} weakens the impact of Byzantine nodes by reducing the variance in local updates using \emph{Polyak's momentum}. Then, by establishing coordination between nodes via {\em signed echo broadcast} and a {\em nearest-neighbor averaging} scheme, we effectively tolerate Byzantine nodes whilst distributing the overhead amongst the non-Byzantine nodes. To demonstrate the correctness of our algorithm, we introduce and analyze a novel {\em Lyapunov function} that accounts for the {\em non-Markovian model drift} arising from the use of momentum. We also demonstrate the efficiency of \newalgorithm{} through experiments on several image classification tasks.

We propose a new "Poisson flow" generative model (PFGM) that maps a uniform distribution on a high-dimensional hemisphere into any data distribution. We interpret the data points as electrical charges on the $z=0$ hyperplane in a space augmented with an additional dimension $z$, generating a high-dimensional electric field (the gradient of the solution to Poisson equation). We prove that if these charges flow upward along electric field lines, their initial distribution in the $z=0$ plane transforms into a distribution on the hemisphere of radius $r$ that becomes uniform in the $r \to\infty$ limit. To learn the bijective transformation, we estimate the normalized field in the augmented space. For sampling, we devise a backward ODE that is anchored by the physically meaningful additional dimension: the samples hit the unaugmented data manifold when the $z$ reaches zero. Experimentally, PFGM achieves current state-of-the-art performance among the normalizing flow models on CIFAR-10, with an Inception score of $9.68$ and a FID score of $2.48$. It also performs on par with the state-of-the-art SDE approaches while offering $10\times $ to $20 \times$ acceleration on image generation tasks. Additionally, PFGM appears more tolerant of estimation errors on a weaker network architecture and robust to the step size in the Euler method. The code is available at https://github.com/Newbeeer/poisson_flow .

Research in machine learning for autism spectrum disorder (ASD) classification bears the promise to improve clinical diagnoses. However, recent studies in clinical imaging have shown the limited generalization of biomarkers across and beyond benchmark datasets. Despite increasing model complexity and sample size in neuroimaging, the classification performance of ASD remains far away from clinical application. This raises the question of how we can overcome these barriers to develop early biomarkers for ASD. One approach might be to rethink how we operationalize the theoretical basis of this disease in machine learning models. Here we introduced unsupervised graph representations that explicitly map the neural mechanisms of a core aspect of ASD, deficits in dyadic social interaction, as assessed by dual brain recordings, termed hyperscanning, and evaluated their predictive performance. The proposed method differs from existing approaches in that it is more suitable to capture social interaction deficits on a neural level and is applicable to young children and infants. First results from functional near-infrared spectroscopy data indicate potential predictive capacities of a task-agnostic, interpretable graph representation. This first effort to leverage interaction-related deficits on neural level to classify ASD may stimulate new approaches and methods to enhance existing models to achieve developmental ASD biomarkers in the future.

Deep learning is playing a vital role in every field which involves data. It has emerged as a strong and efficient framework that can be applied to a broad spectrum of complex learning problems which were difficult to solve using traditional machine learning techniques in the past. In this study we focused on classification of protein sequences with deep learning techniques. The study of amino acid sequence is vital in life sciences. We used different word embedding techniques from Natural Language processing to represent the amino acid sequence as vectors. Our main goal was to classify sequences to four group of classes, that are DNA, RNA, Protein and hybrid. After several tests we have achieved almost 99% of train and test accuracy. We have experimented on CNN, LSTM, Bidirectional LSTM, and GRU.

The goal of this work is to segment and name regions of images without access to pixel-level labels during training. To tackle this task, we construct segmenters by distilling the complementary strengths of two foundation models. The first, CLIP (Radford et al. 2021), exhibits the ability to assign names to image content but lacks an accessible representation of object structure. The second, DINO (Caron et al. 2021), captures the spatial extent of objects but has no knowledge of object names. Our method, termed NamedMask, begins by using CLIP to construct category-specific archives of images. These images are pseudo-labelled with a category-agnostic salient object detector bootstrapped from DINO, then refined by category-specific segmenters using the CLIP archive labels. Thanks to the high quality of the refined masks, we show that a standard segmentation architecture trained on these archives with appropriate data augmentation achieves impressive semantic segmentation abilities for both single-object and multi-object images. As a result, our proposed NamedMask performs favourably against a range of prior work on five benchmarks including the VOC2012, COCO and large-scale ImageNet-S datasets.

Over the last ten years, we have seen a significant increase in industrial data, tremendous improvement in computational power, and major theoretical advances in machine learning. This opens up an opportunity to use modern machine learning tools on large-scale nonlinear monitoring and control problems. This article provides a survey of recent results with applications in the process industry.

In this work, we build recent advances in distributional reinforcement learning to give a state-of-art distributional variant of the model based on the IQN. We achieve this by using the GAN model's generator and discriminator function with the quantile regression to approximate the full quantile value for the state-action return distribution. We demonstrate improved performance on our baseline dataset - 57 Atari 2600 games in the ALE. Also, we use our algorithm to show the state-of-art training performance of risk-sensitive policies in Atari games with the policy optimization and evaluation.

We introduce a flexible framework that produces high-quality almost-exact matches for causal inference. Most prior work in matching uses ad-hoc distance metrics, often leading to poor quality matches, particularly when there are irrelevant covariates. In this work, we learn an interpretable distance metric for matching, which leads to substantially higher quality matches. The learned distance metric stretches the covariate space according to each covariate's contribution to outcome prediction: this stretching means that mismatches on important covariates carry a larger penalty than mismatches on irrelevant covariates. Our ability to learn flexible distance metrics leads to matches that are interpretable and useful for the estimation of conditional average treatment effects.

The cornerstone of neural algorithmic reasoning is the ability to solve algorithmic tasks, especially in a way that generalises out of distribution. While recent years have seen a surge in methodological improvements in this area, they mostly focused on building specialist models. Specialist models are capable of learning to neurally execute either only one algorithm or a collection of algorithms with identical control-flow backbone. Here, instead, we focus on constructing a generalist neural algorithmic learner -- a single graph neural network processor capable of learning to execute a wide range of algorithms, such as sorting, searching, dynamic programming, path-finding and geometry. We leverage the CLRS benchmark to empirically show that, much like recent successes in the domain of perception, generalist algorithmic learners can be built by "incorporating" knowledge. That is, it is possible to effectively learn algorithms in a multi-task manner, so long as we can learn to execute them well in a single-task regime. Motivated by this, we present a series of improvements to the input representation, training regime and processor architecture over CLRS, improving average single-task performance by over 20% from prior art. We then conduct a thorough ablation of multi-task learners leveraging these improvements. Our results demonstrate a generalist learner that effectively incorporates knowledge captured by specialist models.

Out-of-distribution detection seeks to identify novelties, samples that deviate from the norm. The task has been found to be quite challenging, particularly in the case where the normal data distribution consists of multiple semantic classes (e.g., multiple object categories). To overcome this challenge, current approaches require manual labeling of the normal images provided during training. In this work, we tackle multi-class novelty detection without class labels. Our simple but effective solution consists of two stages: we first discover "pseudo-class" labels using unsupervised clustering. Then using these pseudo-class labels, we are able to use standard supervised out-of-distribution detection methods. We verify the performance of our method by a favorable comparison to the state-of-the-art, and provide extensive analysis and ablations.

This work explores the physics-driven machine learning technique Operator Inference (OpInf) for predicting the state of chaotic dynamical systems. OpInf provides a non-intrusive approach to infer approximations of polynomial operators in reduced space without having access to the full order operators appearing in discretized models. Datasets for the physics systems are generated using conventional numerical solvers and then projected to a low-dimensional space via Principal Component Analysis (PCA). In latent space, a least-squares problem is set to fit a quadratic polynomial operator, which is subsequently employed in a time-integration scheme in order to produce extrapolations in the same space. Once solved, the inverse PCA operation is applied to reconstruct the extrapolations in the original space. The quality of the OpInf predictions is assessed via the Normalized Root Mean Squared Error (NRMSE) metric from which the Valid Prediction Time (VPT) is computed. Numerical experiments considering the chaotic systems Lorenz 96 and the Kuramoto-Sivashinsky equation show promising forecasting capabilities of the OpInf reduced order models with VPT ranges that outperform state-of-the-art machine learning methods such as backpropagation and reservoir computing recurrent neural networks [1], as well as Markov neural operators [2].

The temporal and spatial resolution of rainfall data is crucial for environmental modeling studies in which its variability in space and time is considered as a primary factor. Rainfall products from different remote sensing instruments (e.g., radar, satellite) have different space-time resolutions because of the differences in their sensing capabilities and post-processing methods. In this study, we developed a deep learning approach that augments rainfall data with increased time resolutions to complement relatively lower resolution products. We propose a neural network architecture based on Convolutional Neural Networks (CNNs) to improve the temporal resolution of radar-based rainfall products and compare the proposed model with an optical flow-based interpolation method and CNN-baseline model. The methodology presented in this study could be used for enhancing rainfall maps with better temporal resolution and imputation of missing frames in sequences of 2D rainfall maps to support hydrological and flood forecasting studies.

A new gradient-based optimization approach by automatically scheduling the learning rate has been proposed recently, which is called Binary Forward Exploration (BFE). The Adaptive version of BFE has also been discussed thereafter. In this paper, the improved algorithms based on them will be investigated, in order to optimize the efficiency and robustness of the new methodology. This improved approach provides a new perspective to scheduling the update of learning rate and will be compared with the stochastic gradient descent, aka SGD algorithm with momentum or Nesterov momentum and the most successful adaptive learning rate algorithm e.g. Adam. The goal of this method does not aim to beat others but provide a different viewpoint to optimize the gradient descent process. This approach combines the advantages of the first-order and second-order optimizations in the aspects of speed and efficiency.

Recently, increasing efforts are put into learning continual representations for symbolic knowledge bases (KBs). However, these approaches either only embed the data-level knowledge (ABox) or suffer from inherent limitations when dealing with concept-level knowledge (TBox), i.e., they cannot faithfully model the logical structure present in the KBs. We present BoxEL, a geometric KB embedding approach that allows for better capturing the logical structure (i.e., ABox and TBox axioms) in the description logic EL++. BoxEL models concepts in a KB as axis-parallel boxes that are suitable for modeling concept intersection, entities as points inside boxes, and relations between concepts/entities as affine transformations. We show theoretical guarantees (soundness) of BoxEL for preserving logical structure. Namely, the learned model of BoxEL embedding with loss 0 is a (logical) model of the KB. Experimental results on (plausible) subsumption reasonings and a real-world application for protein-protein prediction show that BoxEL outperforms traditional knowledge graph embedding methods as well as state-of-the-art EL++ embedding approaches.

Similarity search is a key operation in multimedia retrieval systems and recommender systems, and it will play an important role also for future machine learning and augmented reality applications. When these systems need to serve large objects with tight delay constraints, edge servers close to the end-user can operate as similarity caches to speed up the retrieval. In this paper we present A\c{C}AI, a new similarity caching policy which improves on the state of the art by using (i) an (approximate) index for the whole catalog to decide which objects to serve locally and which to retrieve from the remote server, and (ii) a mirror ascent algorithm to update the set of local objects with strong guarantees even when the request process does not exhibit any statistical regularity.

Modern deep neural network models are known to erroneously classify out-of-distribution (OOD) test data into one of the in-distribution (ID) training classes with high confidence. This can have disastrous consequences for safety-critical applications. A popular mitigation strategy is to train a separate classifier that can detect such OOD samples at the test time. In most practical settings OOD examples are not known at the train time, and hence a key question is: how to augment the ID data with synthetic OOD samples for training such an OOD detector? In this paper, we propose a novel Compounded Corruption technique for the OOD data augmentation termed CnC. One of the major advantages of CnC is that it does not require any hold-out data apart from the training set. Further, unlike current state-of-the-art (SOTA) techniques, CnC does not require backpropagation or ensembling at the test time, making our method much faster at inference. Our extensive comparison with 20 methods from the major conferences in last 4 years show that a model trained using CnC based data augmentation, significantly outperforms SOTA, both in terms of OOD detection accuracy as well as inference time. We include a detailed post-hoc analysis to investigate the reasons for the success of our method and identify higher relative entropy and diversity of CnC samples as probable causes. We also provide theoretical insights via a piece-wise decomposition analysis on a two-dimensional dataset to reveal (visually and quantitatively) that our approach leads to a tighter boundary around ID classes, leading to better detection of OOD samples. Source code link: https://github.com/cnc-ood

With the ever-increasing availability of data, there has been an explosion of interest in applying modern machine learning methods to fields such as modeling and control. However, despite the flexibility and surprising accuracy of such black-box models, it remains difficult to trust them. Recent efforts to combine the two approaches aim to develop flexible models that nonetheless generalize well; a paradigm we call Hybrid Analysis and modeling (HAM). In this work we investigate the Corrective Source Term Approach (CoSTA), which uses a data-driven model to correct a misspecified physics-based model. This enables us to develop models that make accurate predictions even when the underlying physics of the problem is not well understood. We apply CoSTA to model the Hall-H\'eroult process in an aluminum electrolysis cell. We demonstrate that the method improves both accuracy and predictive stability, yielding an overall more trustworthy model.

An activation function is an element-wise mathematical function and plays a crucial role in deep neural networks (DNN). Many novel and sophisticated activation functions have been proposed to improve the DNN accuracy but also consume massive memory in the training process with back-propagation. In this study, we propose the nested forward automatic differentiation (Forward-AD), specifically for the element-wise activation function for memory-efficient DNN training. We deploy nested Forward-AD in two widely-used deep learning frameworks, TensorFlow and PyTorch, which support the static and dynamic computation graph, respectively. Our evaluation shows that nested Forward-AD reduces the memory footprint by up to 1.97x than the baseline model and outperforms the recomputation by 20% under the same memory reduction ratio.

Recently, sparse training has emerged as a promising paradigm for efficient deep learning on edge devices. The current research mainly devotes efforts to reducing training costs by further increasing model sparsity. However, increasing sparsity is not always ideal since it will inevitably introduce severe accuracy degradation at an extremely high sparsity level. This paper intends to explore other possible directions to effectively and efficiently reduce sparse training costs while preserving accuracy. To this end, we investigate two techniques, namely, layer freezing and data sieving. First, the layer freezing approach has shown its success in dense model training and fine-tuning, yet it has never been adopted in the sparse training domain. Nevertheless, the unique characteristics of sparse training may hinder the incorporation of layer freezing techniques. Therefore, we analyze the feasibility and potentiality of using the layer freezing technique in sparse training and find it has the potential to save considerable training costs. Second, we propose a data sieving method for dataset-efficient training, which further reduces training costs by ensuring only a partial dataset is used throughout the entire training process. We show that both techniques can be well incorporated into the sparse training algorithm to form a generic framework, which we dub SpFDE. Our extensive experiments demonstrate that SpFDE can significantly reduce training costs while preserving accuracy from three dimensions: weight sparsity, layer freezing, and dataset sieving.

Cold temperatures during fall and spring have the potential to cause frost damage to grapevines and other fruit plants, which can significantly decrease harvest yields. To help prevent these losses, farmers deploy expensive frost mitigation measures, such as, sprinklers, heaters, and wind machines, when they judge that damage may occur. This judgment, however, is challenging because the cold hardiness of plants changes throughout the dormancy period and it is difficult to directly measure. This has led scientists to develop cold hardiness prediction models that can be tuned to different grape cultivars based on laborious field measurement data. In this paper, we study whether deep-learning models can improve cold hardiness prediction for grapes based on data that has been collected over a 30-year time period. A key challenge is that the amount of data per cultivar is highly variable, with some cultivars having only a small amount. For this purpose, we investigate the use of multi-task learning to leverage data across cultivars in order to improve prediction performance for individual cultivars. We evaluate a number of multi-task learning approaches and show that the highest performing approach is able to significantly improve over learning for single cultivars and outperforms the current state-of-the-art scientific model for most cultivars.

Some boosting algorithms, such as LPBoost, ERLPBoost, and C-ERLPBoost, aim to solve the soft margin optimization problem with the $\ell_1$-norm regularization. LPBoost rapidly converges to an $\epsilon$-approximate solution in practice, but it is known to take $\Omega(m)$ iterations in the worst case, where $m$ is the sample size. On the other hand, ERLPBoost and C-ERLPBoost are guaranteed to converge to an $\epsilon$-approximate solution in $O(\frac{1}{\epsilon^2} \ln \frac{m}{\nu})$ iterations. However, the computation per iteration is very high compared to LPBoost. To address this issue, we propose a generic boosting scheme that combines the Frank-Wolfe algorithm and any secondary algorithm and switches one to the other iteratively. We show that the scheme retains the same convergence guarantee as ERLPBoost and C-ERLPBoost. One can incorporate any secondary algorithm to improve in practice. This scheme comes from a unified view of boosting algorithms for soft margin optimization. More specifically, we show that LPBoost, ERLPBoost, and C-ERLPBoost are instances of the Frank-Wolfe algorithm. In experiments on real datasets, one of the instances of our scheme exploits the better updates of the secondary algorithm and performs comparably with LPBoost.

The representation of data is of paramount importance for machine learning methods. Kernel methods are used to enrich the feature representation, allowing better generalization. Quantum kernels implement efficiently complex transformation encoding classical data in the Hilbert space of a quantum system, resulting in even exponential speedup. However, we need prior knowledge of the data to choose an appropriate parametric quantum circuit that can be used as quantum embedding. We propose an algorithm that automatically selects the best quantum embedding through a combinatorial optimization procedure that modifies the structure of the circuit, changing the generators of the gates, their angles (which depend on the data points), and the qubits on which the various gates act. Since combinatorial optimization is computationally expensive, we have introduced a criterion based on the exponential concentration of kernel matrix coefficients around the mean to immediately discard an arbitrarily large portion of solutions that are believed to perform poorly. Contrary to the gradient-based optimization (e.g. trainable quantum kernels), our approach is not affected by the barren plateau by construction. We have used both artificial and real-world datasets to demonstrate the increased performance of our approach with respect to randomly generated PQC. We have also compared the effect of different optimization algorithms, including greedy local search, simulated annealing, and genetic algorithms, showing that the algorithm choice largely affects the result.

In this digital era, almost in every discipline people are using automated systems that generate information represented in document format in different natural languages. As a result, there is a growing interest towards better solutions for finding, organizing and analyzing these documents. In this paper, we propose a system that clusters Amharic text documents using Encyclopedic Knowledge (EK) with neural word embedding. EK enables the representation of related concepts and neural word embedding allows us to handle the contexts of the relatedness. During the clustering process, all the text documents pass through preprocessing stages. Enriched text document features are extracted from each document by mapping with EK and word embedding model. TF-IDF weighted vector of enriched feature was generated. Finally, text documents are clustered using popular spherical K-means algorithm. The proposed system is tested with Amharic text corpus and Amharic Wikipedia data. Test results show that the use of EK with word embedding for document clustering improves the average accuracy over the use of only EK. Furthermore, changing the size of the class has a significant effect on accuracy.

We present a self-supervised method to disentangle factors of variation in high-dimensional data that does not rely on prior knowledge of the underlying variation profile (e.g., no assumptions on the number or distribution of the individual latent variables to be extracted). In this method which we call NashAE, high-dimensional feature disentanglement is accomplished in the low-dimensional latent space of a standard autoencoder (AE) by promoting the discrepancy between each encoding element and information of the element recovered from all other encoding elements. Disentanglement is promoted efficiently by framing this as a minmax game between the AE and an ensemble of regression networks which each provide an estimate of an element conditioned on an observation of all other elements. We quantitatively compare our approach with leading disentanglement methods using existing disentanglement metrics. Furthermore, we show that NashAE has increased reliability and increased capacity to capture salient data characteristics in the learned latent representation.

Counterfactual explanations embody one of the many interpretability techniques that receive increasing attention from the machine learning community. Their potential to make model predictions more sensible to the user is considered to be invaluable. To increase their adoption in practice, several criteria that counterfactual explanations should adhere to have been put forward in the literature. We propose counterfactual explanations using optimization with constraint learning (CE-OCL), a generic and flexible approach that addresses all these criteria and allows room for further extensions. Specifically, we discuss how we can leverage an optimization with constraint learning framework for the generation of counterfactual explanations, and how components of this framework readily map to the criteria. We also propose two novel modeling approaches to address data manifold closeness and diversity, which are two key criteria for practical counterfactual explanations. We test CE-OCL on several datasets and present our results in a case study. Compared against the current state-of-the-art methods, CE-OCL allows for more flexibility and has an overall superior performance in terms of several evaluation metrics proposed in related work.

In machine learning, there is renewed interest in neural network ensembles (NNEs), whereby predictions are obtained as an aggregate from a diverse set of smaller models, rather than from a single larger model. Here, we show how to define and train a NNE using techniques from the study of rare trajectories in stochastic systems. We define an NNE in terms of the trajectory of the model parameters under a simple, and discrete in time, diffusive dynamics, and train the NNE by biasing these trajectories towards a small time-integrated loss, as controlled by appropriate counting fields which act as hyperparameters. We demonstrate the viability of this technique on a range of simple supervised learning tasks. We discuss potential advantages of our trajectory sampling approach compared with more conventional gradient based methods.

The accuracy of recent deep learning based clinical decision support systems is promising. However, lack of model interpretability remains an obstacle to widespread adoption of artificial intelligence in healthcare. Using sleep as a case study, we propose a generalizable method to combine clinical interpretability with high accuracy derived from black-box deep learning. Clinician-determined sleep stages from polysomnogram (PSG) remain the gold standard for evaluating sleep quality. However, PSG manual annotation by experts is expensive and time-prohibitive. We propose SERF, interpretable Sleep staging using Embeddings, Rules, and Features to read PSG. SERF provides interpretation of classified sleep stages through meaningful features derived from the AASM Manual for the Scoring of Sleep and Associated Events. In SERF, the embeddings obtained from a hybrid of convolutional and recurrent neural networks are transposed to the interpretable feature space. These representative interpretable features are used to train simple models like a shallow decision tree for classification. Model results are validated on two publicly available datasets. SERF surpasses the current state-of-the-art for interpretable sleep staging by 2%. Using Gradient Boosted Trees as the classifier, SERF obtains 0.766 $\kappa$ and 0.870 AUC-ROC, within 2% of the current state-of-the-art black-box models.

Trajectory optimization methods have achieved an exceptional level of performance on real-world robots in recent years. These methods heavily rely on accurate analytical models of the dynamics, yet some aspects of the physical world can only be captured to a limited extent. An alternative approach is to leverage machine learning techniques to learn a differentiable dynamics model of the system from data. In this work, we use trajectory optimization and model learning for performing highly dynamic and complex tasks with robotic systems in absence of accurate analytical models of the dynamics. We show that a neural network can model highly nonlinear behaviors accurately for large time horizons, from data collected in only 25 minutes of interactions on two distinct robots: (i) the Boston Dynamics Spot and an (ii) RC car. Furthermore, we use the gradients of the neural network to perform gradient-based trajectory optimization. In our hardware experiments, we demonstrate that our learned model can represent complex dynamics for both the Spot and Radio-controlled (RC) car, and gives good performance in combination with trajectory optimization methods.  ( 2 min )

Monitoring biodiversity is paramount to manage and protect natural resources, particularly in times of global change. Collecting images of organisms over large temporal or spatial scales is a promising practice to monitor and study biodiversity change of natural ecosystems, providing large amounts of data with minimal interference with the environment. Deep learning models are currently used to automate classification of organisms into taxonomic units. However, imprecision in these classifiers introduce a measurement noise that is difficult to control and can significantly hinder the analysis and interpretation of data. In our study, we show that this limitation can be overcome by ensembles of Data-efficient image Transformers (DeiTs), which significantly outperform the previous state of the art (SOTA). We validate our results on a large number of ecological imaging datasets of diverse origin, and organisms of study ranging from plankton to insects, birds, dog breeds, animals in the wild, and corals. On all the data sets we test, we achieve a new SOTA, with a reduction of the error with respect to the previous SOTA ranging from 18.48% to 87.50%, depending on the data set, and often achieving performances very close to perfect classification. The main reason why ensembles of DeiTs perform better is not due to the single-model performance of DeiTs, but rather to the fact that predictions by independent models have a smaller overlap, and this maximizes the profit gained by ensembling. This positions DeiT ensembles as the best candidate for image classification in biodiversity monitoring.

This paper develops a Deep Graph Operator Network (DeepGraphONet) framework that learns to approximate the dynamics of a complex system (e.g. the power grid or traffic) with an underlying sub-graph structure. We build our DeepGraphONet by fusing the ability of (i) Graph Neural Networks (GNN) to exploit spatially correlated graph information and (ii) Deep Operator Networks~(DeepONet) to approximate the solution operator of dynamical systems. The resulting DeepGraphONet can then predict the dynamics within a given short/medium-term time horizon by observing a finite history of the graph state information. Furthermore, we design our DeepGraphONet to be resolution-independent. That is, we do not require the finite history to be collected at the exact/same resolution. In addition, to disseminate the results from a trained DeepGraphONet, we design a zero-shot learning strategy that enables using it on a different sub-graph. Finally, empirical results on the (i) transient stability prediction problem of power grids and (ii) traffic flow forecasting problem of a vehicular system illustrate the effectiveness of the proposed DeepGraphONet.

One-bit compressive sensing is concerned with the accurate recovery of an underlying sparse signal of interest from its one-bit noisy measurements. The conventional signal recovery approaches for this problem are mainly developed based on the assumption that an exact knowledge of the sensing matrix is available. In this work, however, we present a novel data-driven and model-based methodology that achieves blind recovery; i.e., signal recovery without requiring the knowledge of the sensing matrix. To this end, we make use of the deep unfolding technique and develop a model-driven deep neural architecture which is designed for this specific task. The proposed deep architecture is able to learn an alternative sensing matrix by taking advantage of the underlying unfolded algorithm such that the resulting learned recovery algorithm can accurately and quickly (in terms of the number of iterations) recover the underlying compressed signal of interest from its one-bit noisy measurements. In addition, due to the incorporation of the domain knowledge and the mathematical model of the system into the proposed deep architecture, the resulting network benefits from enhanced interpretability, has a very small number of trainable parameters, and requires very small number of training samples, as compared to the commonly used black-box deep neural network alternatives for the problem at hand.

Representation disentanglement is an important goal of representation learning that benefits various downstream tasks. To achieve this goal, many unsupervised learning representation disentanglement approaches have been developed. However, the training process without utilizing any supervision signal have been proved to be inadequate for disentanglement representation learning. Therefore, we propose a novel weakly-supervised training approach, named as SW-VAE, which incorporates pairs of input observations as supervision signals by using the generative factors of datasets. Furthermore, we introduce strategies to gradually increase the learning difficulty during training to smooth the training process. As shown on several datasets, our model shows significant improvement over state-of-the-art (SOTA) methods on representation disentanglement tasks.

Instrumental variable models allow us to identify a causal function between covariates $X$ and a response $Y$, even in the presence of unobserved confounding. Most of the existing estimators assume that the error term in the response $Y$ and the hidden confounders are uncorrelated with the instruments $Z$. This is often motivated by a graphical separation, an argument that also justifies independence. Positing an independence restriction, however, leads to strictly stronger identifiability results. We connect to the existing literature in econometrics and provide a practical method called HSIC-X for exploiting independence that can be combined with any gradient-based learning procedure. We see that even in identifiable settings, taking into account higher moments may yield better finite sample results. Furthermore, we exploit the independence for distribution generalization. We prove that the proposed estimator is invariant to distributional shifts on the instruments and worst-case optimal whenever these shifts are sufficiently strong. These results hold even in the under-identified case where the instruments are not sufficiently rich to identify the causal function.

We propose a communication efficient approach for federated learning in heterogeneous environments. The system heterogeneity is reflected in the presence of $K$ different data distributions, with each user sampling data from only one of $K$ distributions. The proposed approach requires only one communication round between the users and server, thus significantly reducing the communication cost. Moreover, the proposed method provides strong learning guarantees in heterogeneous environments, by achieving the optimal mean-squared error (MSE) rates in terms of the sample size, i.e., matching the MSE guarantees achieved by learning on all data points belonging to users with the same data distribution, provided that the number of data points per user is above a threshold that we explicitly characterize in terms of system parameters. Remarkably, this is achieved without requiring any knowledge of the underlying distributions, or even the true number of distributions $K$. Numerical experiments illustrate our findings and underline the performance of the proposed method.

Fair Active Learning (FAL) utilized active learning techniques to achieve high model performance with limited data and to reach fairness between sensitive groups (e.g., genders). However, the impact of the adversarial attack, which is vital for various safety-critical machine learning applications, is not yet addressed in FAL. Observing this, we introduce a novel task, Fair Robust Active Learning (FRAL), integrating conventional FAL and adversarial robustness. FRAL requires ML models to leverage active learning techniques to jointly achieve equalized performance on benign data and equalized robustness against adversarial attacks between groups. In this new task, previous FAL methods generally face the problem of unbearable computational burden and ineffectiveness. Therefore, we develop a simple yet effective FRAL strategy by Joint INconsistency (JIN). To efficiently find samples that can boost the performance and robustness of disadvantaged groups for labeling, our method exploits the prediction inconsistency between benign and adversarial samples as well as between standard and robust models. Extensive experiments under diverse datasets and sensitive groups demonstrate that our method not only achieves fairer performance on benign samples but also obtains fairer robustness under white-box PGD attacks compared with existing active learning and FAL baselines. We are optimistic that FRAL would pave a new path for developing safe and robust ML research and applications such as facial attribute recognition in biometrics systems.

We present the results of the first Machine Learning Gravitational-Wave Search Mock Data Challenge (MLGWSC-1). For this challenge, participating groups had to identify gravitational-wave signals from binary black hole mergers of increasing complexity and duration embedded in progressively more realistic noise. The final of the 4 provided datasets contained real noise from the O3a observing run and signals up to a duration of 20 seconds with the inclusion of precession effects and higher order modes. We present the average sensitivity distance and runtime for the 6 entered algorithms derived from 1 month of test data unknown to the participants prior to submission. Of these, 4 are machine learning algorithms. We find that the best machine learning based algorithms are able to achieve up to 95% of the sensitive distance of matched-filtering based production analyses for simulated Gaussian noise at a false-alarm rate (FAR) of one per month. In contrast, for real noise, the leading machine learning search achieved 70%. For higher FARs the differences in sensitive distance shrink to the point where select machine learning submissions outperform traditional search algorithms at FARs $\geq 200$ per month on some datasets. Our results show that current machine learning search algorithms may already be sensitive enough in limited parameter regions to be useful for some production settings. To improve the state-of-the-art, machine learning algorithms need to reduce the false-alarm rates at which they are capable of detecting signals and extend their validity to regions of parameter space where modeled searches are computationally expensive to run. Based on our findings we compile a list of research areas that we believe are the most important to elevate machine learning searches to an invaluable tool in gravitational-wave signal detection.

This work develops new algorithms with rigorous efficiency guarantees for infinite horizon imitation learning (IL) with linear function approximation without restrictive coherence assumptions. We begin with the minimax formulation of the problem and then outline how to leverage classical tools from optimization, in particular, the proximal-point method (PPM) and dual smoothing, for online and offline IL, respectively. Thanks to PPM, we avoid nested policy evaluation and cost updates for online IL appearing in the prior literature. In particular, we do away with the conventional alternating updates by the optimization of a single convex and smooth objective over both cost and Q-functions. When solved inexactly, we relate the optimization errors to the suboptimality of the recovered policy. As an added bonus, by re-interpreting PPM as dual smoothing with the expert policy as a center point, we also obtain an offline IL algorithm enjoying theoretical guarantees in terms of required expert trajectories. Finally, we achieve convincing empirical performance for both linear and neural network function approximation.

Neurologists are often looking for various "events of interest" when analyzing EEG. To support them in this task various machine-learning-based algorithms have been developed. Most of these algorithms treat the problem as classification, thereby independently processing signal segments and ignoring temporal dependencies inherent to events of varying duration. At inference time, the predicted labels for each segment then have to be post processed to detect the actual events. We propose an end-to-end event detection approach (EventNet), based on deep learning, that directly works with events as learning targets, stepping away from ad-hoc postprocessing schemes to turn model outputs into events. We compare EventNet with a state-of-the-art approach for artefact and and epileptic seizure detection, two event types with highly variable durations. EventNet shows improved performance in detecting both event types. These results show the power of treating events as direct learning targets, instead of using ad-hoc postprocessing to obtain them. Our event detection framework can easily be extended to other event detection problems in signal processing, since the deep learning backbone does not depend on any task-specific features.

We provide theoretical convergence guarantees for score-based generative models (SGMs) such as denoising diffusion probabilistic models (DDPMs), which constitute the backbone of large-scale real-world generative models such as DALL$\cdot$E 2. Our main result is that, assuming accurate score estimates, such SGMs can efficiently sample from essentially any realistic data distribution. In contrast to prior works, our results (1) hold for an $L^2$-accurate score estimate (rather than $L^\infty$-accurate); (2) do not require restrictive functional inequality conditions that preclude substantial non-log-concavity; (3) scale polynomially in all relevant problem parameters; and (4) match state-of-the-art complexity guarantees for discretization of the Langevin diffusion, provided that the score error is sufficiently small. We view this as strong theoretical justification for the empirical success of SGMs. We also examine SGMs based on the critically damped Langevin diffusion (CLD). Contrary to conventional wisdom, we provide evidence that the use of the CLD does not reduce the complexity of SGMs.

Support vector machines (SVM) is one of the well known supervised classes of learning algorithms. Furthermore, the conic-segmentation SVM (CS-SVM) is a natural multiclass analogue of the standard binary SVM, as CS-SVM models are dealing with the situation where the exact values of the data points are known. This paper studies CS-SVM when the data points are uncertain or mislabelled. With some properties known for the distributions, a chance-constrained CS-SVM approach is used to ensure the small probability of misclassification for the uncertain data. The geometric interpretation is presented to show how CS-SVM works. Finally, we present experimental results to investigate the chance constrained CS-SVM's performance.

Existing defenses against adversarial examples such as adversarial training typically assume that the adversary will conform to a specific or known threat model, such as $\ell_p$ perturbations within a fixed budget. In this paper, we focus on the scenario where there is a mismatch in the threat model assumed by the defense during training, and the actual capabilities of the adversary at test time. We ask the question: if the learner trains against a specific "source" threat model, when can we expect robustness to generalize to a stronger unknown "target" threat model during test-time? Our key contribution is to formally define the problem of learning and generalization with an unforeseen adversary, which helps us reason about the increase in adversarial risk from the conventional perspective of a known adversary. Applying our framework, we derive a generalization bound which relates the generalization gap between source and target threat models to variation of the feature extractor, which measures the expected maximum difference between extracted features across a given threat model. Based on our generalization bound, we propose adversarial training with variation regularization (AT-VR) which reduces variation of the feature extractor across the source threat model during training. We empirically demonstrate that AT-VR can lead to improved generalization to unforeseen attacks during test-time compared to standard adversarial training. Additionally, we combine variation regularization with perceptual adversarial training [Laidlaw et al. 2021] to achieve state-of-the-art robustness on unforeseen attacks. Our code is publicly available at https://github.com/inspire-group/variation-regularization.

Particle accelerators are complex facilities that produce large amounts of structured data and have clear optimization goals as well as precisely defined control requirements. As such they are naturally amenable to data-driven research methodologies. The data from sensors and monitors inside the accelerator form multivariate time series. With fast pre-emptive approaches being highly preferred in accelerator control and diagnostics, the application of data-driven time series forecasting methods is particularly promising. This review formulates the time series forecasting problem and summarizes existing models with applications in various scientific areas. Several current and future attempts in the field of particle accelerators are introduced. The application of time series forecasting to particle accelerators has shown encouraging results and the promise for broader use, and existing problems such as data consistency and compatibility have started to be addressed.

In this paper, we study the problem of recovering a low-rank matrix from a number of noisy random linear measurements. We consider the setting where the rank of the ground-truth matrix is unknown a prior and use an overspecified factored representation of the matrix variable, where the global optimal solutions overfit and do not correspond to the underlying ground-truth. We then solve the associated nonconvex problem using gradient descent with small random initialization. We show that as long as the measurement operators satisfy the restricted isometry property (RIP) with its rank parameter scaling with the rank of ground-truth matrix rather than scaling with the overspecified matrix variable, gradient descent iterations are on a particular trajectory towards the ground-truth matrix and achieve nearly information-theoretically optimal recovery when stop appropriately. We then propose an efficient early stopping strategy based on the common hold-out method and show that it detects nearly optimal estimator provably. Moreover, experiments show that the proposed validation approach can also be efficiently used for image restoration with deep image prior which over-parameterizes an image with a deep network.

We study the problem of explainability-first clustering where explainability becomes a first-class citizen for clustering. Previous clustering approaches use decision trees for explanation, but only after the clustering is completed. In contrast, our approach is to perform clustering and decision tree training holistically where the decision tree's performance and size also influence the clustering results. We assume the attributes for clustering and explaining are distinct, although this is not necessary. We observe that our problem is a monotonic optimization where the objective function is a difference of monotonic functions. We then propose an efficient branch-and-bound algorithm for finding the best parameters that lead to a balance of cluster distortion and decision tree explainability. Our experiments show that our method can improve the explainability of any clustering that fits in our framework.

Semidefinite programming (SDP) is a unifying framework that generalizes both linear programming and quadratically-constrained quadratic programming, while also yielding efficient solvers, both in theory and in practice. However, there exist known impossibility results for approximating the optimal solution when constraints for covering SDPs arrive in an online fashion. In this paper, we study online covering linear and semidefinite programs in which the algorithm is augmented with advice from a possibly erroneous predictor. We show that if the predictor is accurate, we can efficiently bypass these impossibility results and achieve a constant-factor approximation to the optimal solution, i.e., consistency. On the other hand, if the predictor is inaccurate, under some technical conditions, we achieve results that match both the classical optimal upper bounds and the tight lower bounds up to constant factors, i.e., robustness. More broadly, we introduce a framework that extends both (1) the online set cover problem augmented with machine-learning predictors, studied by Bamas, Maggiori, and Svensson (NeurIPS 2020), and (2) the online covering SDP problem, initiated by Elad, Kale, and Naor (ICALP 2016). Specifically, we obtain general online learning-augmented algorithms for covering linear programs with fractional advice and constraints, and initiate the study of learning-augmented algorithms for covering SDP problems. Our techniques are based on the primal-dual framework of Buchbinder and Naor (Mathematics of Operations Research, 34, 2009) and can be further adjusted to handle constraints where the variables lie in a bounded region, i.e., box constraints.  ( 3 min )

Epilepsy is one of the most common neurological diseases, characterized by transient and unprovoked events called epileptic seizures. Electroencephalogram (EEG) is an auxiliary method used to perform both the diagnosis and the monitoring of epilepsy. Given the unexpected nature of an epileptic seizure, its prediction would improve patient care, optimizing the quality of life and the treatment of epilepsy. Predicting an epileptic seizure implies the identification of two distinct states of EEG in a patient with epilepsy: the preictal and the interictal. In this paper, we developed two deep learning models called Temporal Multi-Channel Transformer (TMC-T) and Vision Transformer (TMC-ViT), adaptations of Transformer-based architectures for multi-channel temporal signals. Moreover, we accessed the impact of choosing different preictal duration, since its length is not a consensus among experts, and also evaluated how the sample size benefits each model. Our models are compared with fully connected, convolutional, and recurrent networks. The algorithms were patient-specific trained and evaluated on raw EEG signals from the CHB-MIT database. Experimental results and statistical validation demonstrated that our TMC-ViT model surpassed the CNN architecture, state-of-the-art in seizure prediction.  ( 3 min )

Generating high-quality artistic portrait videos is an important and desirable task in computer graphics and vision. Although a series of successful portrait image toonification models built upon the powerful StyleGAN have been proposed, these image-oriented methods have obvious limitations when applied to videos, such as the fixed frame size, the requirement of face alignment, missing non-facial details and temporal inconsistency. In this work, we investigate the challenging controllable high-resolution portrait video style transfer by introducing a novel VToonify framework. Specifically, VToonify leverages the mid- and high-resolution layers of StyleGAN to render high-quality artistic portraits based on the multi-scale content features extracted by an encoder to better preserve the frame details. The resulting fully convolutional architecture accepts non-aligned faces in videos of variable size as input, contributing to complete face regions with natural motions in the output. Our framework is compatible with existing StyleGAN-based image toonification models to extend them to video toonification, and inherits appealing features of these models for flexible style control on color and intensity. This work presents two instantiations of VToonify built upon Toonify and DualStyleGAN for collection-based and exemplar-based portrait video style transfer, respectively. Extensive experimental results demonstrate the effectiveness of our proposed VToonify framework over existing methods in generating high-quality and temporally-coherent artistic portrait videos with flexible style controls.

Most of the popular Big Data analytics tools evolved to adapt their working environment to extract valuable information from a vast amount of unstructured data. The ability of data mining techniques to filter this helpful information from Big Data led to the term Big Data Mining. Shifting the scope of data from small-size, structured, and stable data to huge volume, unstructured, and quickly changing data brings many data management challenges. Different tools cope with these challenges in their own way due to their architectural limitations. There are numerous parameters to take into consideration when choosing the right data management framework based on the task at hand. In this paper, we present a comprehensive benchmark for two widely used Big Data analytics tools, namely Apache Spark and Hadoop MapReduce, on a common data mining task, i.e., classification. We employ several evaluation metrics to compare the performance of the benchmarked frameworks, such as execution time, accuracy, and scalability. These metrics are specialized to measure the performance for classification task. To the best of our knowledge, there is no previous study in the literature that employs all these metrics while taking into consideration task-specific concerns. We show that Spark is 5 times faster than MapReduce on training the model. Nevertheless, the performance of Spark degrades when the input workload gets larger. Scaling the environment by additional clusters significantly improves the performance of Spark. However, similar enhancement is not observed in Hadoop. Machine learning utility of MapReduce tend to have better accuracy scores than that of Spark, like around 3%, even in small size data sets.

Despite decades of research, existing navigation systems still face real-world challenges when deployed in the wild, e.g., in cluttered home environments or in human-occupied public spaces. To address this, we present a new class of implicit control policies combining the benefits of imitation learning with the robust handling of system constraints from Model Predictive Control (MPC). Our approach, called Performer-MPC, uses a learned cost function parameterized by vision context embeddings provided by Performers -- a low-rank implicit-attention Transformer. We jointly train the cost function and construct the controller relying on it, effectively solving end-to-end the corresponding bi-level optimization problem. We show that the resulting policy improves standard MPC performance by leveraging a few expert demonstrations of the desired navigation behavior in different challenging real-world scenarios. Compared with a standard MPC policy, Performer-MPC achieves >40% better goal reached in cluttered environments and >65% better on social metrics when navigating around humans.

Learned optimizers -- neural networks that are trained to act as optimizers -- have the potential to dramatically accelerate training of machine learning models. However, even when meta-trained across thousands of tasks at huge computational expense, blackbox learned optimizers often struggle with stability and generalization when applied to tasks unlike those in their meta-training set. In this paper, we use tools from dynamical systems to investigate the inductive biases and stability properties of optimization algorithms, and apply the resulting insights to designing inductive biases for blackbox optimizers. Our investigation begins with a noisy quadratic model, where we characterize conditions in which optimization is stable, in terms of eigenvalues of the training dynamics. We then introduce simple modifications to a learned optimizer's architecture and meta-training procedure which lead to improved stability, and improve the optimizer's inductive bias. We apply the resulting learned optimizer to a variety of neural network training tasks, where it outperforms the current state of the art learned optimizer -- at matched optimizer computational overhead -- with regard to optimization performance and meta-training speed, and is capable of generalization to tasks far different from those it was meta-trained on.

Knowing the 3D motions in a dynamic scene is essential to many vision applications. Recent progress is mainly focused on estimating the activity of some specific elements like humans. In this paper, we leverage a neural motion field for estimating the motion of all points in a multiview setting. Modeling the motion from a dynamic scene with multiview data is challenging due to the ambiguities in points of similar color and points with time-varying color. We propose to regularize the estimated motion to be predictable. If the motion from previous frames is known, then the motion in the near future should be predictable. Therefore, we introduce a predictability regularization by first conditioning the estimated motion on latent embeddings, then by adopting a predictor network to enforce predictability on the embeddings. The proposed framework PREF (Predictability REgularized Fields) achieves on par or better results than state-of-the-art neural motion field-based dynamic scene representation methods, while requiring no prior knowledge of the scene.  ( 2 min )

We study the problem of finding the Nash equilibrium in a two-player zero-sum Markov game. Due to its formulation as a minimax optimization program, a natural approach to solve the problem is to perform gradient descent/ascent with respect to each player in an alternating fashion. However, due to the non-convexity/non-concavity of the underlying objective function, theoretical understandings of this method are limited. In our paper, we consider solving an entropy-regularized variant of the Markov game. The regularization introduces structure into the optimization landscape that make the solutions more identifiable and allow the problem to be solved more efficiently. Our main contribution is to show that under proper choices of the regularization parameter, the gradient descent ascent algorithm converges to the Nash equilibrium of the original unregularized problem. We explicitly characterize the finite-time performance of the last iterate of our algorithm, which vastly improves over the existing convergence bound of the gradient descent ascent algorithm without regularization. Finally, we complement the analysis with numerical simulations that illustrate the accelerated convergence of the algorithm.

MATSim (Multi-Agent Transport Simulation Toolkit) is an open source large-scale agent-based transportation planning project applied to various areas like road transport, public transport, freight transport, regional evacuation, etc. BEAM (Behavior, Energy, Autonomy, and Mobility) framework extends MATSim to enable powerful and scalable analysis of urban transportation systems. The agents from the BEAM simulation exhibit 'mode choice' behavior based on multinomial logit model. In our study, we consider eight mode choices viz. bike, car, walk, ride hail, driving to transit, walking to transit, ride hail to transit, and ride hail pooling. The 'alternative specific constants' for each mode choice are critical hyperparameters in a configuration file related to a particular scenario under experimentation. We use the 'Urbansim-10k' BEAM scenario (with 10,000 population size) for all our experiments. Since these hyperparameters affect the simulation in complex ways, manual calibration methods are time consuming. We present a parallel Bayesian optimization method with early stopping rule to achieve fast convergence for the given multi-in-multi-out problem to its optimal configurations. Our model is based on an open source HpBandSter package. This approach combines hierarchy of several 1D Kernel Density Estimators (KDE) with a cheap evaluator (Hyperband, a single multidimensional KDE). Our model has also incorporated extrapolation based early stopping rule. With our model, we could achieve a 25% L1 norm for a large-scale BEAM simulation in fully autonomous manner. To the best of our knowledge, our work is the first of its kind applied to large-scale multi-agent transportation simulations. This work can be useful for surrogate modeling of scenarios with very large populations.

Nonconvex-concave minimax optimization has received intense interest in machine learning, including learning with robustness to data distribution, learning with non-decomposable loss, adversarial learning, to name a few. Nevertheless, most existing works focus on the gradient-descent-ascent (GDA) variants that can only be applied in smooth settings. In this paper, we consider a family of minimax problems whose objective function enjoys the nonsmooth composite structure in the variable of minimization and is concave in the variables of maximization. By fully exploiting the composite structure, we propose a smoothed proximal linear descent ascent (\textit{smoothed} PLDA) algorithm and further establish its $\mathcal{O}(\epsilon^{-4})$ iteration complexity, which matches that of smoothed GDA~\cite{zhang2020single} under smooth settings. Moreover, under the mild assumption that the objective function satisfies the one-sided Kurdyka-\L{}ojasiewicz condition with exponent $\theta \in (0,1)$, we can further improve the iteration complexity to $\mathcal{O}(\epsilon^{-2\max\{2\theta,1\}})$. To the best of our knowledge, this is the first provably efficient algorithm for nonsmooth nonconvex-concave problems that can achieve the optimal iteration complexity $\mathcal{O}(\epsilon^{-2})$ if $\theta \in (0,1/2]$. As a byproduct, we discuss different stationarity concepts and clarify their relationships quantitatively, which could be of independent interest. Empirically, we illustrate the effectiveness of the proposed smoothed PLDA in variation regularized Wasserstein distributionally robust optimization problems.

Every year, thousands of innocent people die due to heart attacks. Often undiagnosed heart attacks can hit people by surprise since many current medical plans don't cover the costs to require the searching of calcification on these scans. Only if someone is suspected to have a heart problem, a gated CT scan is taken, otherwise, there's no way for the patient to be aware of a possible heart attack/disease. While nongated CT scans are more periodically taken, it is harder to detect calcification and is usually taken for a purpose other than locating calcification in arteries. In fact, in real time coronary artery calcification scores are only calculated on gated CT scans, not nongated CT scans. After training a unet model on the Coronary Calcium and chest CT's gated scans, it received a DICE coefficient of 0.95 on its untouched test set. This model was used to predict on nongated CT scans, performing with a mean absolute error (MAE) of 674.19 and bucket classification accuracy of 41% (5 classes). Through the analysis of the images and the information stored in the images, mathematical equations were derived and used to automatically crop the images around the location of the heart. By performing semi-supervised learning the new cropped nongated scans were able to closely resemble gated CT scans, improving the performance by 91% in MAE (62.38) and 23% in accuracy.

Neural networks with physics based inductive biases such as Lagrangian neural networks (LNN), and Hamiltonian neural networks (HNN) learn the dynamics of physical systems by encoding strong inductive biases. Alternatively, Neural ODEs with appropriate inductive biases have also been shown to give similar performances. However, these models, when applied to particle based systems, are transductive in nature and hence, do not generalize to large system sizes. In this paper, we present a graph based neural ODE, GNODE, to learn the time evolution of dynamical systems. Further, we carefully analyse the role of different inductive biases on the performance of GNODE. We show that, similar to LNN and HNN, encoding the constraints explicitly can significantly improve the training efficiency and performance of GNODE significantly. Our experiments also assess the value of additional inductive biases, such as Newtons third law, on the final performance of the model. We demonstrate that inducing these biases can enhance the performance of model by orders of magnitude in terms of both energy violation and rollout error. Interestingly, we observe that the GNODE trained with the most effective inductive biases, namely MCGNODE, outperforms the graph versions of LNN and HNN, namely, Lagrangian graph networks (LGN) and Hamiltonian graph networks (HGN) in terms of energy violation error by approx 4 orders of magnitude for a pendulum system, and approx 2 orders of magnitude for spring systems. These results suggest that competitive performances with energy conserving neural networks can be obtained for NODE based systems by inducing appropriate inductive biases.

Personalized federated learning (FL) facilitates collaborations between multiple clients to learn personalized models without sharing private data. The mechanism mitigates the statistical heterogeneity commonly encountered in the system, i.e., non-IID data over different clients. Existing personalized algorithms generally assume all clients volunteer for personalization. However, potential participants might still be reluctant to personalize models since they might not work well. In this case, clients choose to use the global model instead. To avoid making unrealistic assumptions, we introduce the personalization rate, measured as the fraction of clients willing to train personalized models, into federated settings and propose DyPFL. This dynamically personalized FL technique incentivizes clients to participate in personalizing local models while allowing the adoption of the global model when it performs better. We show that the algorithmic pipeline in DyPFL guarantees good convergence performance, allowing it to outperform alternative personalized methods in a broad range of conditions, including variation in heterogeneity, number of clients, local epochs, and batch sizes.

Various structures in human physiology follow a treelike morphology, which often expresses complexity at very fine scales. Examples of such structures are intrathoracic airways, retinal blood vessels, and hepatic blood vessels. Large collections of 2D and 3D images have been made available by medical imaging modalities such as magnetic resonance imaging (MRI), computed tomography (CT), Optical coherence tomography (OCT) and ultrasound in which the spatial arrangement can be observed. Segmentation of these structures in medical imaging is of great importance since the analysis of the structure provides insights into disease diagnosis, treatment planning, and prognosis. Manually labelling extensive data by radiologists is often time-consuming and error-prone. As a result, automated or semi-automated computational models have become a popular research field of medical imaging in the past two decades, and many have been developed to date. In this survey, we aim to provide a comprehensive review of currently publicly available datasets, segmentation algorithms, and evaluation metrics. In addition, current challenges and future research directions are discussed.

Bayesian optimisation (BO) algorithms have shown remarkable success in applications involving expensive black-box functions. Traditionally BO has been set as a sequential decision-making process which estimates the utility of query points via an acquisition function and a prior over functions, such as a Gaussian process. Recently, however, a reformulation of BO via density-ratio estimation (BORE) allowed reinterpreting the acquisition function as a probabilistic binary classifier, removing the need for an explicit prior over functions and increasing scalability. In this paper, we present a theoretical analysis of BORE's regret and an extension of the algorithm with improved uncertainty estimates. We also show that BORE can be naturally extended to a batch optimisation setting by recasting the problem as approximate Bayesian inference. The resulting algorithm comes equipped with theoretical performance guarantees and is assessed against other batch BO baselines in a series of experiments.

Normalizing Flows (NF) are powerful likelihood-based generative models that are able to trade off between expressivity and tractability to model complex densities. A now well established research avenue leverages optimal transport (OT) and looks for Monge maps, i.e. models with minimal effort between the source and target distributions. This paper introduces a method based on Brenier's polar factorization theorem to transform any trained NF into a more OT-efficient version without changing the final density. We do so by learning a rearrangement of the source (Gaussian) distribution that minimizes the OT cost between the source and the final density. We further constrain the path leading to the estimated Monge map to lie on a geodesic in the space of volume-preserving diffeomorphisms thanks to Euler's equations. The proposed method leads to smooth flows with reduced OT cost for several existing models without affecting the model performance.

Transporter Net is a recently proposed framework for pick and place that is able to learn good manipulation policies from a very few expert demonstrations. A key reason why Transporter Net is so sample efficient is that the model incorporates rotational equivariance into the pick module, i.e. the model immediately generalizes learned pick knowledge to objects presented in different orientations. This paper proposes a novel version of Transporter Net that is equivariant to both pick and place orientation. As a result, our model immediately generalizes place knowledge to different place orientations in addition to generalizing pick knowledge as before. Ultimately, our new model is more sample efficient and achieves better pick and place success rates than the baseline Transporter Net model.

Early sensory systems in the brain rapidly adapt to fluctuating input statistics, which requires recurrent communication between neurons. Mechanistically, such recurrent communication is often indirect and mediated by local interneurons. In this work, we explore the computational benefits of mediating recurrent communication via interneurons compared with direct recurrent connections. To this end, we consider two mathematically tractable recurrent neural networks that statistically whiten their inputs -- one with direct recurrent connections and the other with interneurons that mediate recurrent communication. By analyzing the corresponding continuous synaptic dynamics and numerically simulating the networks, we show that the network with interneurons is more robust to initialization than the network with direct recurrent connections in the sense that the convergence time for the synaptic dynamics in the network with interneurons (resp. direct recurrent connections) scales logarithmically (resp. linearly) with the spectrum of their initialization. Our results suggest that interneurons are computationally useful for rapid adaptation to changing input statistics. Interestingly, the network with interneurons is an overparameterized solution of the whitening objective for the network with direct recurrent connections, so our results can be viewed as a recurrent neural network analogue of the implicit acceleration phenomenon observed in overparameterized feedforward linear networks.

K-Nearest Neighbor (kNN)-based deep learning methods have been applied to many applications due to their simplicity and geometric interpretability. However, the robustness of kNN-based classification models has not been thoroughly explored and kNN attack strategies are underdeveloped. In this paper, we propose an Adversarial Soft kNN (ASK) loss to both design more effective kNN attack strategies and to develop better defenses against them. Our ASK loss approach has two advantages. First, ASK loss can better approximate the kNN's probability of classification error than objectives proposed in previous works. Second, the ASK loss is interpretable: it preserves the mutual information between the perturbed input and the in-class-reference data. We use the ASK loss to generate a novel attack method called the ASK-Attack (ASK-Atk), which shows superior attack efficiency and accuracy degradation relative to previous kNN attacks. Based on the ASK-Atk, we then derive an ASK-\underline{Def}ense (ASK-Def) method that optimizes the worst-case training loss induced by ASK-Atk. Experiments on CIFAR-10 (ImageNet) show that (i) ASK-Atk achieves $\geq 13\%$ ($\geq 13\%$) improvement in attack success rate over previous kNN attacks, and (ii) ASK-Def outperforms the conventional adversarial training method by $\geq 6.9\%$ ($\geq 3.5\%$) in terms of robustness improvement.

Non-negative matrix factorization with transform learning (TL-NMF) is a recent idea that aims at learning data representations suited to NMF. In this work, we relate TL-NMF to the classical matrix joint-diagonalization (JD) problem. We show that, when the number of data realizations is sufficiently large, TL-NMF can be replaced by a two-step approach -- termed as JD+NMF -- that estimates the transform through JD, prior to NMF computation. In contrast, we found that when the number of data realizations is limited, not only is JD+NMF no longer equivalent to TL-NMF, but the inherent low-rank constraint of TL-NMF turns out to be an essential ingredient to learn meaningful transforms for NMF.

This paper introduces a new simulation-based inference procedure to model and sample from multi-dimensional probability distributions given access to i.i.d.\ samples, circumventing the usual approaches of explicitly modeling the density function or designing Markov chain Monte Carlo. Motivated by the seminal work on distance and isomorphism between metric measure spaces, we propose a new notion called the Reversible Gromov-Monge (RGM) distance and study how RGM can be used to design new transform samplers to perform simulation-based inference. Our RGM sampler can also estimate optimal alignments between two heterogeneous metric measure spaces $(\cX, \mu, c_{\cX})$ and $(\cY, \nu, c_{\cY})$ from empirical data sets, with estimated maps that approximately push forward one measure $\mu$ to the other $\nu$, and vice versa. We study the analytic properties of the RGM distance and derive that under mild conditions, RGM equals the classic Gromov-Wasserstein distance. Curiously, drawing a connection to Brenier's polar factorization, we show that the RGM sampler induces bias towards strong isomorphism with proper choices of $c_{\cX}$ and $c_{\cY}$. Statistical rate of convergence, representation, and optimization questions regarding the induced sampler are studied. Synthetic and real-world examples showcasing the effectiveness of the RGM sampler are also demonstrated.  ( 3 min )

Convolution-augmented transformers (Conformers) are recently proposed in various speech-domain applications, such as automatic speech recognition (ASR) and speech separation, as they can capture both local and global dependencies. In this paper, we propose a conformer-based metric generative adversarial network (CMGAN) for speech enhancement (SE) in the time-frequency (TF) domain. The generator encodes the magnitude and complex spectrogram information using two-stage conformer blocks to model both time and frequency dependencies. The decoder then decouples the estimation into a magnitude mask decoder branch to filter out unwanted distortions and a complex refinement branch to further improve the magnitude estimation and implicitly enhance the phase information. Additionally, we include a metric discriminator to alleviate metric mismatch by optimizing the generator with respect to a corresponding evaluation score. Objective and subjective evaluations illustrate that CMGAN is able to show superior performance compared to state-of-the-art methods in three speech enhancement tasks (denoising, dereverberation and super-resolution). For instance, quantitative denoising analysis on Voice Bank+DEMAND dataset indicates that CMGAN outperforms various previous models with a margin, i.e., PESQ of 3.41 and SSNR of 11.10 dB.  ( 2 min )

Story visualization aims to generate a sequence of images to narrate each sentence in a multi-sentence story with a global consistency across dynamic scenes and characters. Current works still struggle with output images' quality and consistency, and rely on additional semantic information or auxiliary captioning networks. To address these challenges, we first introduce a new sentence representation, which incorporates word information from all story sentences to mitigate the inconsistency problem. Then, we propose a new discriminator with fusion features and further extend the spatial attention to improve image quality and story consistency. Extensive experiments on different datasets and human evaluation demonstrate the superior performance of our approach, compared to state-of-the-art methods, neither using segmentation masks nor auxiliary captioning networks.  ( 2 min )

Recent advances in Explainable AI (XAI) increased the demand for deployment of safe and interpretable AI models in various industry sectors. Despite the latest success of deep neural networks in a variety of domains, understanding the decision-making process of such complex models still remains a challenging task for domain experts. Especially in the financial domain, merely pointing to an anomaly composed of often hundreds of mixed type columns, has limited value for experts. Hence, in this paper, we propose a framework for explaining anomalies using denoising autoencoders designed for mixed type tabular data. We specifically focus our technique on anomalies that are erroneous observations. This is achieved by localizing individual sample columns (cells) with potential errors and assigning corresponding confidence scores. In addition, the model provides the expected cell value estimates to fix the errors. We evaluate our approach based on three standard public tabular datasets (Credit Default, Adult, IEEE Fraud) and one proprietary dataset (Holdings). We find that denoising autoencoders applied to this task already outperform other approaches in the cell error detection rates as well as in the expected value rates. Additionally, we analyze how a specialized loss designed for cell error detection can further improve these metrics. Our framework is designed for a domain expert to understand abnormal characteristics of an anomaly, as well as to improve in-house data quality management processes.

In this paper, we introduce a new algorithm based on archetypal analysis for blind hyperspectral unmixing, assuming linear mixing of endmembers. Archetypal analysis is a natural formulation for this task. This method does not require the presence of pure pixels (i.e., pixels containing a single material) but instead represents endmembers as convex combinations of a few pixels present in the original hyperspectral image. Our approach leverages an entropic gradient descent strategy, which (i) provides better solutions for hyperspectral unmixing than traditional archetypal analysis algorithms, and (ii) leads to efficient GPU implementations. Since running a single instance of our algorithm is fast, we also propose an ensembling mechanism along with an appropriate model selection procedure that make our method robust to hyper-parameter choices while keeping the computational complexity reasonable. By using six standard real datasets, we show that our approach outperforms state-of-the-art matrix factorization and recent deep learning methods. We also provide an open-source PyTorch implementation: https://github.com/inria-thoth/EDAA.

Deep neural networks have become the gold-standard approach for the automated segmentation of 3D medical images. Their full acceptance by clinicians remains however hampered by the lack of intelligible uncertainty assessment of the provided results. Most approaches to quantify their uncertainty, such as the popular Monte Carlo dropout, restrict to some measure of uncertainty in prediction at the voxel level. In addition not to be clearly related to genuine medical uncertainty, this is not clinically satisfying as most objects of interest (e.g. brain lesions) are made of groups of voxels whose overall relevance may not simply reduce to the sum or mean of their individual uncertainties. In this work, we propose to go beyond voxel-wise assessment using an innovative Graph Neural Network approach, trained from the outputs of a Monte Carlo dropout model. This network allows the fusion of three estimators of voxel uncertainty: entropy, variance, and model's confidence; and can be applied to any lesion, regardless of its shape or size. We demonstrate the superiority of our approach for uncertainty estimate on a task of Multiple Sclerosis lesions segmentation.

Multiclass probability estimation is the problem of estimating conditional probabilities of a data point belonging to a class given its covariate information. It has broad applications in statistical analysis and data science. Recently a class of weighted Support Vector Machines (wSVMs) has been developed to estimate class probabilities through ensemble learning for $K$-class problems (Wu, Zhang and Liu, 2010; Wang, Zhang and Wu, 2019), where $K$ is the number of classes. The estimators are robust and achieve high accuracy for probability estimation, but their learning is implemented through pairwise coupling, which demands polynomial time in $K$. In this paper, we propose two new learning schemes, the baseline learning and the One-vs-All (OVA) learning, to further improve wSVMs in terms of computational efficiency and estimation accuracy. In particular, the baseline learning has optimal computational complexity in the sense that it is linear in $K$. Though not being most efficient in computation, the OVA offers the best estimation accuracy among all the procedures under comparison. The resulting estimators are distribution-free and shown to be consistent. We further conduct extensive numerical experiments to demonstrate finite sample performance.

Clinical diagnosis of the eye is performed over multifarious data modalities including scalar clinical labels, vectorized biomarkers, two-dimensional fundus images, and three-dimensional Optical Coherence Tomography (OCT) scans. Clinical practitioners use all available data modalities for diagnosing and treating eye diseases like Diabetic Retinopathy (DR) or Diabetic Macular Edema (DME). Enabling usage of machine learning algorithms within the ophthalmic medical domain requires research into the relationships and interactions between all relevant data over a treatment period. Existing datasets are limited in that they neither provide data nor consider the explicit relationship modeling between the data modalities. In this paper, we introduce the Ophthalmic Labels for Investigating Visual Eye Semantics (OLIVES) dataset that addresses the above limitation. This is the first OCT and near-IR fundus dataset that includes clinical labels, biomarker labels, disease labels, and time-series patient treatment information from associated clinical trials. The dataset consists of 1268 near-IR fundus images each with at least 49 OCT scans, and 16 biomarkers, along with 4 clinical labels and a disease diagnosis of DR or DME. In total, there are 96 eyes' data averaged over a period of at least two years with each eye treated for an average of 66 weeks and 7 injections. We benchmark the utility of OLIVES dataset for ophthalmic data as well as provide benchmarks and concrete research directions for core and emerging machine learning paradigms within medical image analysis.

Ball bearing joints are a critical component in all rotating machinery, and detecting and locating faults in these joints is a significant problem in industry and research. Intelligent fault detection (IFD) is the process of applying machine learning and other statistical methods to monitor the health states of machines. This paper explores the construction of vibration images, a preprocessing technique that has been previously used to train convolutional neural networks for ball bearing joint IFD. The main results demonstrate the robustness of this technique by applying it to a larger dataset than previously used and exploring the hyperparameters used in constructing the vibration images.  ( 2 min )

Situating at the core of Artificial Intelligence (AI), Machine Learning (ML), and more specifically, Deep Learning (DL) have embraced great success in the past two decades. However, unseen class label prediction is far less explored due to missing classes being invisible in training ML or DL models. In this work, we propose a fuzzy inference system to cope with such a challenge by adopting TSK+ fuzzy inference engine in conjunction with the Curvature-based Feature Selection (CFS) method. The practical feasibility of our system has been evaluated by predicting the positioning labels of networking devices within the realm of the Internet of Things (IoT). Competitive prediction performance confirms the efficiency and efficacy of our system, especially when a large number of continuous class labels are unseen during the model training stage.  ( 2 min )

Many real-life optimization problems frequently contain one or more constraints or objectives for which there are no explicit formulas. If data is however available, these data can be used to learn the constraints. The benefits of this approach are clearly seen, however there is a need for this process to be carried out in a structured manner. This paper therefore provides a framework for Optimization with Constraint Learning (OCL) which we believe will help to formalize and direct the process of learning constraints from data. This framework includes the following steps: (i) setup of the conceptual optimization model, (ii) data gathering and preprocessing, (iii) selection and training of predictive models, (iv) resolution of the optimization model, and (v) verification and improvement of the optimization model. We then review the recent OCL literature in light of this framework, and highlight current trends, as well as areas for future research.

Deep residual networks (ResNets) have shown state-of-the-art performance in various real-world applications. Recently, the ResNets model was reparameterized and interpreted as solutions to a continuous ordinary differential equation or Neural-ODE model. In this study, we propose a neural generalized ordinary differential equation (Neural-GODE) model with layer-varying parameters to further extend the Neural-ODE to approximate the discrete ResNets. Specifically, we use nonparametric B-spline functions to parameterize the Neural-GODE so that the trade-off between the model complexity and computational efficiency can be easily balanced. It is demonstrated that ResNets and Neural-ODE models are special cases of the proposed Neural-GODE model. Based on two benchmark datasets, MNIST and CIFAR-10, we show that the layer-varying Neural-GODE is more flexible and general than the standard Neural-ODE. Furthermore, the Neural-GODE enjoys the computational and memory benefits while performing comparably to ResNets in prediction accuracy.  ( 2 min )

Off-road autonomous unmanned ground vehicles (UGVs) are being developed for military and commercial use to deliver crucial supplies in remote locations, help with mapping and surveillance, and to assist war-fighters in contested environments. Due to complexity of the off-road environments and variability in terrain, lighting conditions, diurnal and seasonal changes, the models used to perceive the environment must handle a lot of input variability. Current datasets used to train perception models for off-road autonomous navigation lack of diversity in seasons, locations, semantic classes, as well as time of day. We test the hypothesis that model trained on a single dataset may not generalize to other off-road navigation datasets and new locations due to the input distribution drift. Additionally, we investigate how to combine multiple datasets to train a semantic segmentation-based environment perception model and we show that training the model to capture uncertainty could improve the model performance by a significant margin. We extend the Masksembles approach for uncertainty quantification to the semantic segmentation task and compare it with Monte Carlo Dropout and standard baselines. Finally, we test the approach against data collected from a UGV platform in a new testing environment. We show that the developed perception model with uncertainty quantification can be feasibly deployed on an UGV to support online perception and navigation tasks.

Time series data are ubiquitous in real-world applications. However, one of the most common problems is that the time series data could have missing values by the inherent nature of the data collection process. So imputing missing values from multivariate (correlated) time series data is imperative to improve a prediction performance while making an accurate data-driven decision. Conventional works for imputation simply delete missing values or fill them based on mean/zero. Although recent works based on deep neural networks have shown remarkable results, they still have a limitation to capture the complex generation process of the multivariate time series. In this paper, we propose a novel imputation method for multivariate time series data, called STING (Self-attention based Time-series Imputation Networks using GAN). We take advantage of generative adversarial networks and bidirectional recurrent neural networks to learn latent representations of the time series. In addition, we introduce a novel attention mechanism to capture the weighted correlations of the whole sequence and avoid potential bias brought by unrelated ones. Experimental results on three real-world datasets demonstrate that STING outperforms the existing state-of-the-art methods in terms of imputation accuracy as well as downstream tasks with the imputed values therein.

When learning from sensitive data, care must be taken to ensure that training algorithms address privacy concerns. The canonical Private Aggregation of Teacher Ensembles, or PATE, computes output labels by aggregating the predictions of a (possibly distributed) collection of teacher models via a voting mechanism. The mechanism adds noise to attain a differential privacy guarantee with respect to the teachers' training data. In this work, we observe that this use of noise, which makes PATE predictions stochastic, enables new forms of leakage of sensitive information. For a given input, our adversary exploits this stochasticity to extract high-fidelity histograms of the votes submitted by the underlying teachers. From these histograms, the adversary can learn sensitive attributes of the input such as race, gender, or age. Although this attack does not directly violate the differential privacy guarantee, it clearly violates privacy norms and expectations, and would not be possible at all without the noise inserted to obtain differential privacy. In fact, counter-intuitively, the attack becomes easier as we add more noise to provide stronger differential privacy. We hope this encourages future work to consider privacy holistically rather than treat differential privacy as a panacea.

Considering the functionality of situational awareness in safety-critical automation systems, the perception of risk in driving scenes and its explainability is of particular importance for autonomous and cooperative driving. Toward this goal, this paper proposes a new research direction of joint risk localization in driving scenes and its risk explanation as a natural language description. Due to the lack of standard benchmarks, we collected a large-scale dataset, DRAMA (Driving Risk Assessment Mechanism with A captioning module), which consists of 17,785 interactive driving scenarios collected in Tokyo, Japan. Our DRAMA dataset accommodates video- and object-level questions on driving risks with associated important objects to achieve the goal of visual captioning as a free-form language description utilizing closed and open-ended responses for multi-level questions, which can be used to evaluate a range of visual captioning capabilities in driving scenarios. We make this data available to the community for further research. Using DRAMA, we explore multiple facets of joint risk localization and captioning in interactive driving scenarios. In particular, we benchmark various multi-task prediction architectures and provide a detailed analysis of joint risk localization and risk captioning. The data set is available at https://usa.honda-ri.com/drama

Recently, manipulation of real-world images has been highly elaborated along with the development of Generative Adversarial Networks (GANs) and corresponding encoders, which embed real-world images into the latent space. However, designing encoders of GAN still remains a challenging task due to the trade-off between distortion and perception. In this paper, we point out that the existing encoders try to lower the distortion not only on the interest region, e.g., human facial region but also on the uninterest region, e.g., background patterns and obstacles. However, most uninterest regions in real-world images are located at out-of-distribution (OOD), which are infeasible to be ideally reconstructed by generative models. Moreover, we empirically find that the uninterest region overlapped with the interest region can mangle the original feature of the interest region, e.g., a microphone overlapped with a facial region is inverted into the white beard. As a result, lowering the distortion of the whole image while maintaining the perceptual quality is very challenging. To overcome this trade-off, we propose a simple yet effective encoder training scheme, coined IntereStyle, which facilitates encoding by focusing on the interest region. IntereStyle steers the encoder to disentangle the encodings of the interest and uninterest regions. To this end, we filter the information of the uninterest region iteratively to regulate the negative impact of the uninterest region. We demonstrate that IntereStyle achieves both lower distortion and higher perceptual quality compared to the existing state-of-the-art encoders. Especially, our model robustly conserves features of the original images, which shows the robust image editing and style mixing results. We will release our code with the pre-trained model after the review.

In this era, the moment has arrived to move away from disease as the primary emphasis of medical treatment. Although impressive, the multiple techniques that have been developed to detect the diseases. In this time, there are some types of diseases COVID-19, normal flue, migraine, lung disease, heart disease, kidney disease, diabetics, stomach disease, gastric, bone disease, autism are the very common diseases. In this analysis, we analyze disease symptoms and have done disease predictions based on their symptoms. We studied a range of symptoms and took a survey from people in order to complete the task. Several classification algorithms have been employed to train the model. Furthermore, performance evaluation matrices are used to measure the model's performance. Finally, we discovered that the part classifier surpasses the others.

Machine learning has had a great deal of success in image processing. However, the focus of this work has largely been on realistic images, ignoring more niche art styles such as pixel art. Additionally, many traditional machine learning models that focus on groups of pixels do not work well with pixel art, where individual pixels are important. We propose the Pixel VQ-VAE, a specialized VQ-VAE model that learns representations of pixel art. We show that it outperforms other models in both the quality of embeddings as well as performance on downstream tasks.

We suggest the first system that runs real-time semantic segmentation via deep learning on a weak micro-computer such as the Raspberry Pi Zero v2 (whose price was \$15) attached to a toy-drone. In particular, since the Raspberry Pi weighs less than $16$ grams, and its size is half of a credit card, we could easily attach it to the common commercial DJI Tello toy-drone (<\$100, <90 grams, 98 $\times$ 92.5 $\times$ 41 mm). The result is an autonomous drone (no laptop nor human in the loop) that can detect and classify objects in real-time from a video stream of an on-board monocular RGB camera (no GPS or LIDAR sensors). The companion videos demonstrate how this Tello drone scans the lab for people (e.g. for the use of firefighters or security forces) and for an empty parking slot outside the lab. Existing deep learning solutions are either much too slow for real-time computation on such IoT devices, or provide results of impractical quality. Our main challenge was to design a system that takes the best of all worlds among numerous combinations of networks, deep learning platforms/frameworks, compression techniques, and compression ratios. To this end, we provide an efficient searching algorithm that aims to find the optimal combination which results in the best tradeoff between the network running time and its accuracy/performance.

The core principle of Variational Inference (VI) is to convert the statistical inference problem of computing complex posterior probability densities into a tractable optimization problem. This property enables VI to be faster than several sampling-based techniques. However, the traditional VI algorithm is not scalable to large data sets and is unable to readily infer out-of-bounds data points without re-running the optimization process. Recent developments in the field, like stochastic-, black box- and amortized-VI, have helped address these issues. Generative modeling tasks nowadays widely make use of amortized VI for its efficiency and scalability, as it utilizes a parameterized function to learn the approximate posterior density parameters. With this paper, we review the mathematical foundations of various VI techniques to form the basis for understanding amortized VI. Additionally, we provide an overview of the recent trends that address several issues of amortized VI, such as the amortization gap, generalization issues, inconsistent representation learning, and posterior collapse. Finally, we analyze alternate divergence measures that improve VI optimization.

There have been several recent efforts towards developing representations for multivariate time-series in an unsupervised learning framework. Such representations can prove beneficial in tasks such as activity recognition, health monitoring, and anomaly detection. In this paper, we consider a setting where we observe time-series at each node in a dynamic graph. We propose a framework called GraphTNC for unsupervised learning of joint representations of the graph and the time-series. Our approach employs a contrastive learning strategy. Based on an assumption that the time-series and graph evolution dynamics are piecewise smooth, we identify local windows of time where the signals exhibit approximate stationarity. We then train an encoding that allows the distribution of signals within a neighborhood to be distinguished from the distribution of non-neighboring signals. We first demonstrate the performance of our proposed framework using synthetic data, and subsequently we show that it can prove beneficial for the classification task with real-world datasets.

Advanced researches on connected vehicles have recently targeted to the integration of vehicle-to-everything (V2X) networks with Machine Learning (ML) tools and distributed decision making. Federated learning (FL) is emerging as a new paradigm to train machine learning (ML) models in distributed systems, including vehicles in V2X networks. Rather than sharing and uploading the training data to the server, the updating of model parameters (e.g., neural networks' weights and biases) is applied by large populations of interconnected vehicles, acting as local learners. Despite these benefits, the limitation of existing approaches is the centralized optimization which relies on a server for aggregation and fusion of local parameters, leading to the drawback of a single point of failure and scaling issues for increasing V2X network size. Meanwhile, in intelligent transport scenarios, data collected from onboard sensors are redundant, which degrades the performance of aggregation. To tackle these problems, we explore a novel idea of decentralized data processing and introduce a federated learning framework for in-network vehicles, C-DFL(Consensus based Decentralized Federated Learning), to tackle federated learning on connected vehicles and improve learning quality. Extensive simulations have been implemented to evaluate the performance of C-DFL, that demonstrates C-DFL outperforms the performance of conventional methods in all cases.

AASM guidelines are the results of decades of efforts to try to standardize the sleep scoring procedure as to have a commonly used methodology. The guidelines cover several aspects from the technical/digital specifications, e.g., recommended EEG derivations, to the sleep scoring rules, e.g., different rules for adults, children and infants. In the context of sleep scoring automation, in the last decades, deep learning has demonstrated better performance compared to many other approaches. In most of the cases, clinical knowledge and guidelines have been exploited to support the automated sleep scoring algorithms in solving the task. In this paper we show that, actually, a deep learning based sleep scoring algorithm may not need to fully exploit the clinical knowledge or to strictly follow the AASM guidelines. Specifically, we demonstrate that U-Sleep, a state-of-the-art sleep scoring algorithm, can be strong enough to solve the scoring task even using clinically non-recommended or non-conventional derivations, and with no need to exploit information about the chronological age of the subjects. We finally strengthen a well-known finding that using data from multiple data centers always results in a better performing model compared with training on a single cohort. Indeed, we show that this latter statement is still valid even by increasing the size and the heterogeneity of the single data cohort. In all our experiments we used 28528 polysomnography studies from 13 different clinical studies.

The Vision Transformer architecture has shown to be competitive in the computer vision (CV) space where it has dethroned convolution-based networks in several benchmarks. Nevertheless, Convolutional Neural Networks (CNN) remain the preferential architecture for the representation module in Reinforcement Learning. In this work, we study pretraining a Vision Transformer using several state-of-the-art self-supervised methods and assess data-efficiency gains from this training framework. We propose a new self-supervised learning method called TOV-VICReg that extends VICReg to better capture temporal relations between observations by adding a temporal order verification task. Furthermore, we evaluate the resultant encoders with Atari games in a sample-efficiency regime. Our results show that the vision transformer, when pretrained with TOV-VICReg, outperforms the other self-supervised methods but still struggles to overcome a CNN. Nevertheless, we were able to outperform a CNN in two of the ten games where we perform a 100k steps evaluation. Ultimately, we believe that such approaches in Deep Reinforcement Learning (DRL) might be the key to achieving new levels of performance as seen in natural language processing and computer vision. Source code will be available at: https://github.com/mgoulao/TOV-VICReg

In lifelong learning, an agent learns throughout its entire life without resets, in a constantly changing environment, as we humans do. Consequently, lifelong learning comes with a plethora of research problems such as continual domain shifts, which result in non-stationary rewards and environment dynamics. These non-stationarities are difficult to detect and cope with due to their continuous nature. Therefore, exploration strategies and learning methods are required that are capable of tracking the steady domain shifts, and adapting to them. We propose Reactive Exploration to track and react to continual domain shifts in lifelong reinforcement learning, and to update the policy correspondingly. To this end, we conduct experiments in order to investigate different exploration strategies. We empirically show that representatives of the policy-gradient family are better suited for lifelong learning, as they adapt more quickly to distribution shifts than Q-learning. Thereby, policy-gradient methods profit the most from Reactive Exploration and show good results in lifelong learning with continual domain shifts. Our code is available at: https://github.com/ml-jku/reactive-exploration.

Deep learning has made significant applications in the field of data science and natural science. Some studies have linked deep neural networks to dynamic systems, but the network structure is restricted to the residual network. It is known that residual networks can be regarded as a numerical discretization of dynamic systems. In this paper, we back to the classical network structure and prove that the vanilla feedforward networks could also be a numerical discretization of dynamic systems, where the width of the network is equal to the dimension of the input and output. Our proof is based on the properties of the leaky-ReLU function and the numerical technique of splitting method to solve differential equations. Our results could provide a new perspective for understanding the approximation properties of feedforward neural networks.

Graph neural networks (GNNs) have been extensively used for many domains where data are represented as graphs, including social networks, recommender systems, biology, chemistry, etc. Recently, the expressive power of GNNs has drawn much interest. It has been shown that, despite the promising empirical results achieved by GNNs for many applications, there are some limitations in GNNs that hinder their performance for some tasks. For example, since GNNs update node features mainly based on local information, they have limited expressive power in capturing long-range dependencies among nodes in graphs. To address some of the limitations of GNNs, several recent works started to explore augmenting GNNs with memory for improving their expressive power in the relevant tasks. In this paper, we provide a comprehensive review of the existing literature of memory-augmented GNNs. We review these works through the lens of psychology and neuroscience, which has established multiple memory systems and mechanisms in biological brains. We propose a taxonomy of the memory GNN works, as well as a set of criteria for comparing the memory mechanisms. We also provide critical discussions on the limitations of these works. Finally, we discuss the challenges and future directions for this area.

The relationship between perceptual loudness and physical attributes of sound is an important subject in both computer music and psychoacoustics. Early studies of "equal-loudness contour" can trace back to the 1920s and the measured loudness with respect to intensity and frequency has been revised many times since then. However, most studies merely focus on synthesized sound, and the induced theories on natural tones with complex timbre have rarely been justified. To this end, we investigate both theory and applications of natural-tone loudness perception in this paper via modeling piano tone. The theory part contains: 1) an accurate measurement of piano-tone equal-loudness contour of pitches, and 2) a machine-learning model capable of inferring loudness purely based on spectral features trained on human subject measurements. As for the application, we apply our theory to piano control transfer, in which we adjust the MIDI velocities on two different player pianos (in different acoustic environments) to achieve the same perceptual effect. Experiments show that both our theoretical loudness modeling and the corresponding performance control transfer algorithm significantly outperform their baselines.

Leveraging quantum effects in metrology such as entanglement and coherence allows one to measure parameters with enhanced sensitivity. However, time-dependent noise can disrupt such Heisenberg-limited amplification. We propose a quantum-metrology method based on the quantum-signal-processing framework to overcome these realistic noise-induced limitations in practical quantum metrology. Our algorithm separates the gate parameter $\varphi$~(single-qubit Z phase) that is susceptible to time-dependent error from the target gate parameter $\theta$~(swap-angle between |10> and |01> states) that is largely free of time-dependent error. Our method achieves an accuracy of $10^{-4}$ radians in standard deviation for learning $\theta$ in superconducting-qubit experiments, outperforming existing alternative schemes by two orders of magnitude. We also demonstrate the increased robustness in learning time-dependent gate parameters through fast Fourier transformation and sequential phase difference. We show both theoretically and numerically that there is an interesting transition of the optimal metrology variance scaling as a function of circuit depth $d$ from the pre-asymptotic regime $d \ll 1/\theta$ to Heisenberg limit $d \to \infty$. Remarkably, in the pre-asymptotic regime our method's estimation variance on time-sensitive parameter $\varphi$ scales faster than the asymptotic Heisenberg limit as a function of depth, $\text{Var}(\hat{\varphi})\approx 1/d^4$. Our work is the first quantum-signal-processing algorithm that demonstrates practical application in laboratory quantum computers.

We consider the problem of solving robust Markov decision process (MDP), which involves a set of discounted, finite state, finite action space MDPs with uncertain transition kernels. The goal of planning is to find a robust policy that optimizes the worst-case values against the transition uncertainties, and thus encompasses the standard MDP planning as a special case. For $(\mathbf{s},\mathbf{a})$-rectangular uncertainty sets, we develop a policy-based first-order method, namely the robust policy mirror descent (RPMD), and establish an $\mathcal{O}(\log(1/\epsilon))$ and $\mathcal{O}(1/\epsilon)$ iteration complexity for finding an $\epsilon$-optimal policy, with two increasing-stepsize schemes. The prior convergence of RPMD is applicable to any Bregman divergence, provided the policy space has bounded radius measured by the divergence when centering at the initial policy. Moreover, when the Bregman divergence corresponds to the squared euclidean distance, we establish an $\mathcal{O}(\max \{1/\epsilon, 1/(\eta \epsilon^2)\})$ complexity of RPMD with any constant stepsize $\eta$. For a general class of Bregman divergences, a similar complexity is also established for RPMD with constant stepsizes, provided the uncertainty set satisfies the relative strong convexity. We further develop a stochastic variant, named SRPMD, when the first-order information is only available through online interactions with the nominal environment. For general Bregman divergences, we establish an $\mathcal{O}(1/\epsilon^2)$ and $\mathcal{O}(1/\epsilon^3)$ sample complexity with two increasing-stepsize schemes. For the euclidean Bregman divergence, we establish an $\mathcal{O}(1/\epsilon^3)$ sample complexity with constant stepsizes. To the best of our knowledge, all the aforementioned results appear to be new for policy-based first-order methods applied to the robust MDP problem.

A keyword search on constrained clustering on Web-of-Science returned just under 3,000 documents. We ran automatic analyses of those, and compiled our own bibliography of 183 papers which we analysed in more detail based on their topic and experimental study, if any. This paper presents general trends of the area and its sub-topics by Pareto analysis, using citation count and year of publication. We list available software and analyse the experimental sections of our reference collection. We found a notable lack of large comparison experiments. Among the topics we reviewed, applications studies were most abundant recently, alongside deep learning, active learning and ensemble learning.

There may exist multiple models that perform almost equally well for any given prediction task. We examine how predictions change across these competing models. In particular, we study predictive multiplicity -- in probabilistic classification. We formally define measures for our setting and develop optimization-based methods to compute these measures for convex empirical risk minimization problems. We apply our methodology to gain insight into why predictive multiplicity arises. We demonstrate the incidence and prevalence of predictive multiplicity in real-world risk assessment tasks. Our results emphasize the need to report multiplicity more widely.

In real-world applications of multi-class classification models, misclassification in an important class (e.g., stop sign) can be significantly more harmful than in other classes (e.g., speed limit). In this paper, we propose a loss function that can improve the recall of an important class while maintaining the same level of accuracy as the case using cross-entropy loss. For our purpose, we need to make the separation of the important class better than the other classes. However, existing methods that give a class-sensitive penalty for cross-entropy loss do not improve the separation. On the other hand, the method that gives a margin to the angle between the feature vectors and the weight vectors of the last fully connected layer corresponding to each feature can improve the separation. Therefore, we propose a loss function that can improve the separation of the important class by setting the margin only for the important class, called Class-sensitive Additive Angular Margin Loss (CAMRI Loss). CAMRI loss is expected to reduce the variance of angles between features and weights of the important class relative to other classes due to the margin around the important class in the feature space by adding a penalty to the angle. In addition, concentrating the penalty only on the important classes hardly sacrifices the separation of the other classes. Experiments on CIFAR-10, GTSRB, and AwA2 showed that the proposed method could improve up to 9% recall improvement on cross-entropy loss without sacrificing accuracy.

In this paper, we present a system to showcase the capabilities of the latest state-of-the-art retrieval augmented generation models trained on knowledge-intensive language tasks, such as slot filling, open domain question answering, dialogue, and fact-checking. Moreover, given a user query, we show how the output from these different models can be combined to cross-examine the outputs of each other. Particularly, we show how accuracy in dialogue can be improved using the question answering model. We are also releasing all models used in the demo as a contribution of this paper. A short video demonstrating the system is available at https://ibm.box.com/v/emnlp2022-demo.

Modern robots require accurate forecasts to make optimal decisions in the real world. For example, self-driving cars need an accurate forecast of other agents' future actions to plan safe trajectories. Current methods rely heavily on historical time series to accurately predict the future. However, relying entirely on the observed history is problematic since it could be corrupted by noise, have outliers, or not completely represent all possible outcomes. To solve this problem, we propose a novel framework for generating robust forecasts for robotic control. In order to model real-world factors affecting future forecasts, we introduce the notion of an adversary, which perturbs observed historical time series to increase a robot's ultimate control cost. Specifically, we model this interaction as a zero-sum two-player game between a robot's forecaster and this hypothetical adversary. We show that our proposed game may be solved to a local Nash equilibrium using gradient-based optimization techniques. Furthermore, we show that a forecaster trained with our method performs 30.14% better on out-of-distribution real-world lane change data than baselines.

Word Error Rate (WER) is the primary metric used to assess automatic speech recognition (ASR) model quality. It has been shown that ASR models tend to have much higher WER on speakers with speech impairments than typical English speakers. It is hard to determine if models can be be useful at such high error rates. This study investigates the use of BERTScore, an evaluation metric for text generation, to provide a more informative measure of ASR model quality and usefulness. Both BERTScore and WER were compared to prediction errors manually annotated by Speech Language Pathologists for error type and assessment. BERTScore was found to be more correlated with human assessment of error type and assessment. BERTScore was specifically more robust to orthographic changes (contraction and normalization errors) where meaning was preserved. Furthermore, BERTScore was a better fit of error assessment than WER, as measured using an ordinal logistic regression and the Akaike's Information Criterion (AIC). Overall, our findings suggest that BERTScore can complement WER when assessing ASR model performance from a practical perspective, especially for accessibility applications where models are useful even at lower accuracy than for typical speech.

The ability to generalize compositionally is key to understanding the potentially infinite number of sentences that can be constructed in a human language from only a finite number of words. Investigating whether NLP models possess this ability has been a topic of interest: SCAN (Lake and Baroni, 2018) is one task specifically proposed to test for this property. Previous work has achieved impressive empirical results using a group-equivariant neural network that naturally encodes a useful inductive bias for SCAN (Gordon et al., 2020). Inspired by this, we introduce a novel group-equivariant architecture that incorporates a group-invariant hard alignment mechanism. We find that our network's structure allows it to develop stronger equivariance properties than existing group-equivariant approaches. We additionally find that it outperforms previous group-equivariant networks empirically on the SCAN task. Our results suggest that integrating group-equivariance into a variety of neural architectures is a potentially fruitful avenue of research, and demonstrate the value of careful analysis of the theoretical properties of such architectures.

A clustering outcome for high-dimensional data is typically interpreted via post-processing, involving dimension reduction and subsequent visualization. This destroys the meaning of the data and obfuscates interpretations. We propose algorithm-agnostic interpretation methods to explain clustering outcomes in reduced dimensions while preserving the integrity of the data. The permutation feature importance for clustering represents a general framework based on shuffling feature values and measuring changes in cluster assignments through custom score functions. The individual conditional expectation for clustering indicates observation-wise changes in the cluster assignment due to changes in the data. The partial dependence for clustering evaluates average changes in cluster assignments for the entire feature space. All methods can be used with any clustering algorithm able to reassign instances through soft or hard labels. In contrast to common post-processing methods such as principal component analysis, the introduced methods maintain the original structure of the features.

The "Curse of Dimensionality" induced by the rapid development of information science, might have a negative impact when dealing with big datasets. In this paper, we propose a variant of the sparrow search algorithm (SSA), called Tent L\'evy flying sparrow search algorithm (TFSSA), and use it to select the best subset of features in the packing pattern for classification purposes. SSA is a recently proposed algorithm that has not been systematically applied to feature selection problems. After verification by the CEC2020 benchmark function, TFSSA is used to select the best feature combination to maximize classification accuracy and minimize the number of selected features. The proposed TFSSA is compared with nine algorithms in the literature. Nine evaluation metrics are used to properly evaluate and compare the performance of these algorithms on twenty-one datasets from the UCI repository. Furthermore, the approach is applied to the coronavirus disease (COVID-19) dataset, yielding the best average classification accuracy and the average number of feature selections, respectively, of 93.47% and 2.1. Experimental results confirm the advantages of the proposed algorithm in improving classification accuracy and reducing the number of selected features compared to other wrapper-based algorithms.

We introduce a simulation-based, amortised Bayesian inference scheme to infer the parameters of random walks. Our approach learns the posterior distribution of the walks' parameters with a likelihood-free method. In the first step a graph neural network is trained on simulated data to learn optimized low-dimensional summary statistics of the random walk. In the second step an invertible neural network generates the posterior distribution of the parameters from the learnt summary statistics using variational inference. We apply our method to infer the parameters of the fractional Brownian motion model from single trajectories. The computational complexity of the amortized inference procedure scales linearly with trajectory length, and its precision scales similarly to the Cram{\'e}r-Rao bound over a wide range of lengths. The approach is robust to positional noise, and generalizes well to trajectories longer than those seen during training. Finally, we adapt this scheme to show that a finite decorrelation time in the environment can furthermore be inferred from individual trajectories.

Robotics has long been a field riddled with complex systems architectures whose modules and connections, whether traditional or learning-based, require significant human expertise and prior knowledge. Inspired by large pre-trained language models, this work introduces a paradigm for pre-training a general purpose representation that can serve as a starting point for multiple tasks on a given robot. We present the Perception-Action Causal Transformer (PACT), a generative transformer-based architecture that aims to build representations directly from robot data in a self-supervised fashion. Through autoregressive prediction of states and actions over time, our model implicitly encodes dynamics and behaviors for a particular robot. Our experimental evaluation focuses on the domain of mobile agents, where we show that this robot-specific representation can function as a single starting point to achieve distinct tasks such as safe navigation, localization and mapping. We evaluate two form factors: a wheeled robot that uses a LiDAR sensor as perception input (MuSHR), and a simulated agent that uses first-person RGB images (Habitat). We show that finetuning small task-specific networks on top of the larger pretrained model results in significantly better performance compared to training a single model from scratch for all tasks simultaneously, and comparable performance to training a separate large model for each task independently. By sharing a common good-quality representation across tasks we can lower overall model capacity and speed up the real-time deployment of such systems.

Subseasonal forecasting $\unicode{x2013}$ predicting temperature and precipitation 2 to 6 weeks $\unicode{x2013}$ ahead is critical for effective water allocation, wildfire management, and drought and flood mitigation. Recent international research efforts have advanced the subseasonal capabilities of operational dynamical models, yet temperature and precipitation prediction skills remains poor, partly due to stubborn errors in representing atmospheric dynamics and physics inside dynamical models. To counter these errors, we introduce an adaptive bias correction (ABC) method that combines state-of-the-art dynamical forecasts with observations using machine learning. When applied to the leading subseasonal model from the European Centre for Medium-Range Weather Forecasts (ECMWF), ABC improves temperature forecasting skill by 60-90% and precipitation forecasting skill by 40-69% in the contiguous U.S. We couple these performance improvements with a practical workflow, based on Cohort Shapley, for explaining ABC skill gains and identifying higher-skill windows of opportunity based on specific climate conditions.

Uncertainty plays a key role in future prediction. The future is uncertain. That means there might be many possible futures. A future prediction method should cover the whole possibilities to be robust. In autonomous driving, covering multiple modes in the prediction part is crucially important to make safety-critical decisions. Although computer vision systems have advanced tremendously in recent years, future prediction remains difficult today. Several examples are uncertainty of the future, the requirement of full scene understanding, and the noisy outputs space. In this thesis, we propose solutions to these challenges by modeling the motion explicitly in a stochastic way and learning the temporal dynamics in a latent space.

In recent years, decentralized learning has emerged as a powerful tool not only for large-scale machine learning, but also for preserving privacy. One of the key challenges in decentralized learning is that the data distribution held by each node is statistically heterogeneous. To address this challenge, the primal-dual algorithm called the Edge-Consensus Learning (ECL) was proposed and was experimentally shown to be robust to the heterogeneity of data distributions. However, the convergence rate of the ECL is provided only when the objective function is convex, and has not been shown in a standard machine learning setting where the objective function is non-convex. Furthermore, the intuitive reason why the ECL is robust to the heterogeneity of data distributions has not been investigated. In this work, we first investigate the relationship between the ECL and Gossip algorithm and show that the update formulas of the ECL can be regarded as correcting the local stochastic gradient in the Gossip algorithm. Then, we propose the Generalized ECL (G-ECL), which contains the ECL as a special case, and provide the convergence rates of the G-ECL in both (strongly) convex and non-convex settings, which do not depend on the heterogeneity of data distributions. Through synthetic experiments, we demonstrate that the numerical results of both the G-ECL and ECL coincide with the convergence rate of the G-ECL.

The design choices in the Transformer attention mechanism, including weak inductive bias and quadratic computational complexity, have limited its application for modeling long sequences. In this paper, we introduce Mega, a simple, theoretically grounded, single-head gated attention mechanism equipped with (exponential) moving average to incorporate inductive bias of position-aware local dependencies into the position-agnostic attention mechanism. We further propose a variant of Mega that offers linear time and space complexity yet yields only minimal quality loss, by efficiently splitting the whole sequence into multiple chunks with fixed length. Extensive experiments on a wide range of sequence modeling benchmarks, including the Long Range Arena, neural machine translation, auto-regressive language modeling, and image and speech classification, show that Mega achieves significant improvements over other sequence models, including variants of Transformers and recent state space models.

We study norm-based uniform convergence bounds for neural networks, aiming at a tight understanding of how these are affected by the architecture and type of norm constraint, for the simple class of scalar-valued one-hidden-layer networks, and inputs bounded in Euclidean norm. We begin by proving that in general, controlling the spectral norm of the hidden layer weight matrix is insufficient to get uniform convergence guarantees (independent of the network width), while a stronger Frobenius norm control is sufficient, extending and improving on previous work. Motivated by the proof constructions, we identify and analyze two important settings where (perhaps surprisingly) a mere spectral norm control turns out to be sufficient: First, when the network's activation functions are sufficiently smooth (with the result extending to deeper networks); and second, for certain types of convolutional networks. In the latter setting, we study how the sample complexity is additionally affected by parameters such as the amount of overlap between patches and the overall number of patches.

Existing data-driven methods for draping garments over posed human bodies, despite being effective, cannot handle garments of arbitrary topology and are typically not end-to-end differentiable. To address these limitations, we propose an end-to-end differentiable pipeline that represents garments using implicit surfaces and learns a skinning field conditioned on shape and pose parameters of an articulated body model. To limit body-garment interpenetrations and artifacts, we propose an interpretation-aware pre-processing strategy of training data and a novel training loss that penalizes self-intersections while draping garments. We demonstrate that our method yields more accurate results for garment reconstruction and deformation with respect to state-of-the-art methods. Furthermore, we show that our method, thanks to its end-to-end differentiability, allows to recover body and garments parameters jointly from image observations, something that previous work could not do.

Neural networks often pack many unrelated concepts into a single neuron - a puzzling phenomenon known as 'polysemanticity' which makes interpretability much more challenging. This paper provides a toy model where polysemanticity can be fully understood, arising as a result of models storing additional sparse features in "superposition." We demonstrate the existence of a phase change, a surprising connection to the geometry of uniform polytopes, and evidence of a link to adversarial examples. We also discuss potential implications for mechanistic interpretability.

Multi-label learning (MLL) learns from the examples each associated with multiple labels simultaneously, where the high cost of annotating all relevant labels for each training example is challenging for real-world applications. To cope with the challenge, we investigate single-positive multi-label learning (SPMLL) where each example is annotated with only one relevant label and show that one can successfully learn a theoretically grounded multi-label classifier for the problem. In this paper, a novel SPMLL method named {\proposed}, i.e., Single-positive MultI-label learning with Label Enhancement, is proposed. Specifically, an unbiased risk estimator is derived, which could be guaranteed to approximately converge to the optimal risk minimizer of fully supervised learning and shows that one positive label of each instance is sufficient to train the predictive model. Then, the corresponding empirical risk estimator is established via recovering the latent soft label as a label enhancement process, where the posterior density of the latent soft labels is approximate to the variational Beta density parameterized by an inference model. Experiments on benchmark datasets validate the effectiveness of the proposed method.

This paper proposes SCALES, a general framework that translates well-established fairness principles into a common representation based on the Constraint Markov Decision Process (CMDP). With the help of causal language, our framework can place constraints on both the procedure of decision making (procedural fairness) as well as the outcomes resulting from decisions (outcome fairness). Specifically, we show that well-known fairness principles can be encoded either as a utility component, a non-causal component, or a causal component in a SCALES-CMDP. We illustrate SCALES using a set of case studies involving a simulated healthcare scenario and the real-world COMPAS dataset. Experiments demonstrate that our framework produces fair policies that embody alternative fairness principles in single-step and sequential decision-making scenarios.

Boosting is a celebrated machine learning approach which is based on the idea of combining weak and moderately inaccurate hypotheses to a strong and accurate one. We study boosting under the assumption that the weak hypotheses belong to a class of bounded capacity. This assumption is inspired by the common convention that weak hypotheses are "rules-of-thumbs" from an "easy-to-learn class". (Schapire and Freund~'12, Shalev-Shwartz and Ben-David '14.) Formally, we assume the class of weak hypotheses has a bounded VC dimension. We focus on two main questions: (i) Oracle Complexity: How many weak hypotheses are needed to produce an accurate hypothesis? We design a novel boosting algorithm and demonstrate that it circumvents a classical lower bound by Freund and Schapire ('95, '12). Whereas the lower bound shows that $\Omega({1}/{\gamma^2})$ weak hypotheses with $\gamma$-margin are sometimes necessary, our new method requires only $\tilde{O}({1}/{\gamma})$ weak hypothesis, provided that they belong to a class of bounded VC dimension. Unlike previous boosting algorithms which aggregate the weak hypotheses by majority votes, the new boosting algorithm uses more complex ("deeper") aggregation rules. We complement this result by showing that complex aggregation rules are in fact necessary to circumvent the aforementioned lower bound. (ii) Expressivity: Which tasks can be learned by boosting weak hypotheses from a bounded VC class? Can complex concepts that are "far away" from the class be learned? Towards answering the first question we {introduce combinatorial-geometric parameters which capture expressivity in boosting.} As a corollary we provide an affirmative answer to the second question for well-studied classes, including half-spaces and decision stumps. Along the way, we establish and exploit connections with Discrepancy Theory.

The principal reason for measuring mental workload is to quantify the cognitive cost of performing tasks to predict human performance. Unfortunately, a method for assessing mental workload that has general applicability does not exist yet. This research presents a novel self-supervised method for mental workload modelling from EEG data employing Deep Learning and a continuous brain rate, an index of cognitive activation, without requiring human declarative knowledge. This method is a convolutional recurrent neural network trainable with spatially preserving spectral topographic head-maps from EEG data to fit the brain rate variable. Findings demonstrate the capacity of the convolutional layers to learn meaningful high-level representations from EEG data since within-subject models had a test Mean Absolute Percentage Error average of 11%. The addition of a Long-Short Term Memory layer for handling sequences of high-level representations was not significant, although it did improve their accuracy. Findings point to the existence of quasi-stable blocks of learnt high-level representations of cognitive activation because they can be induced through convolution and seem not to be dependent on each other over time, intuitively matching the non-stationary nature of brain responses. Across-subject models, induced with data from an increasing number of participants, thus containing more variability, obtained a similar accuracy to the within-subject models. This highlights the potential generalisability of the induced high-level representations across people, suggesting the existence of subject-independent cognitive activation patterns. This research contributes to the body of knowledge by providing scholars with a novel computational method for mental workload modelling that aims to be generally applicable, does not rely on ad-hoc human-crafted models supporting replicability and falsifiability.

Inverted landing in a rapid and robust manner is a challenging feat for aerial robots, especially while depending entirely on onboard sensing and computation. In spite of this, this feat is routinely performed by biological fliers such as bats, flies, and bees. Our previous work has identified a direct causal connection between a series of onboard visual cues and kinematic actions that allow for reliable execution of this challenging aerobatic maneuver in small aerial robots. In this work, we first utilized Deep Reinforcement Learning and a physics-based simulation to obtain a general, optimal control policy for robust inverted landing starting from any arbitrary approach condition. This optimized control policy provides a computationally-efficient mapping from the system's observational space to its motor command action space, including both triggering and control of rotational maneuvers. This was done by training the system over a large range of approach flight velocities that varied with magnitude and direction. Next, we performed a sim-to-real transfer and experimental validation of the learned policy via domain randomization, by varying the robot's inertial parameters in the simulation. Through experimental trials, we identified several dominant factors which greatly improved landing robustness and the primary mechanisms that determined inverted landing success. We expect the learning framework developed in this study can be generalized to solve more challenging tasks, such as utilizing noisy onboard sensory data, landing on surfaces of various orientations, or landing on dynamically-moving surfaces.

We consider the problem of explaining a class of tractable deep probabilistic models, the Sum-Product Networks (SPNs) and present an algorithm ExSPN to generate explanations. To this effect, we define the notion of a context-specific independence tree(CSI-tree) and present an iterative algorithm that converts an SPN to a CSI-tree. The resulting CSI-tree is both interpretable and explainable to the domain expert. We achieve this by extracting the conditional independencies encoded by the SPN and approximating the local context specified by the structure of the SPN. Our extensive empirical evaluations on synthetic, standard, and real-world clinical data sets demonstrate that the CSI-tree exhibits superior explainability.

Machine learning potentials are an important tool for molecular simulation, but their development is held back by a shortage of high quality datasets to train them on. We describe the SPICE dataset, a new quantum chemistry dataset for training potentials relevant to simulating drug-like small molecules interacting with proteins. It contains over 1.1 million conformations for a diverse set of small molecules, dimers, dipeptides, and solvated amino acids. It includes 15 elements, charged and uncharged molecules, and a wide range of covalent and non-covalent interactions. It provides both forces and energies calculated at the {\omega}B97M-D3(BJ)/def2-TZVPPD level of theory, along with other useful quantities such as multipole moments and bond orders. We train a set of machine learning potentials on it and demonstrate that they can achieve chemical accuracy across a broad region of chemical space. It can serve as a valuable resource for the creation of transferable, ready to use potential functions for use in molecular simulations.

Estimating individual treatment effects (ITEs) from observational data is relevant in many fields such as personalized medicine. However, in practice, the treatment assignment is usually confounded by unobserved variables and thus introduces bias. A remedy to remove the bias is the use of instrumental variables (IVs). Such settings are widespread in medicine (e.g., trials where compliance is used as binary IV). In this paper, we propose a novel, multiply robust machine learning framework, called MRIV, for estimating ITEs using binary IVs and thus yield an unbiased ITE estimator. Different from previous work for binary IVs, our framework estimates the ITE directly via a pseudo outcome regression. (1) We provide a theoretical analysis where we show that our framework yields multiply robust convergence rates: our ITE estimator achieves fast convergence even if several nuisance estimators converge slowly. (2) We further show that our framework asymptotically outperforms state-of-the-art plug-in IV methods for ITE estimation. (3) We build upon our theoretical results and propose a tailored deep neural network architecture called MRIV-Net for ITE estimation using binary IVs. Across various computational experiments, we demonstrate empirically that our MRIV-Net achieves state-of-the-art performance. To the best of our knowledge, our MRIV is the first machine learning framework for estimating ITEs in the binary IV setting shown to be multiply robust.

In previous work a novel Edge Lightweight Searchable Attribute-based encryption (ELSA) method was proposed to support Industry 4.0 and specifically Industrial Internet of Things applications. In this paper, we aim to improve ELSA by minimising the lookup table size and summarising the data records by integrating Machine Learning (ML) methods suitable for execution at the edge. This integration will eliminate records of unnecessary data by evaluating added value to further processing. Thus, resulting in the minimization of both the lookup table size, the cloud storage and the network traffic taking full advantage of the edge architecture benefits. We demonstrate our mini-ELSA expanded method on a well-known power plant dataset. Our results demonstrate a reduction of storage requirements by 21% while improving execution time by 1.27x.

Estimating terrain traversability in off-road environments requires reasoning about complex interaction dynamics between the robot and these terrains. However, it is challenging to build an accurate physics model, or create informative labels to learn a model in a supervised manner, for these interactions. We propose a method that learns to predict traversability costmaps by combining exteroceptive environmental information with proprioceptive terrain interaction feedback in a self-supervised manner. Additionally, we propose a novel way of incorporating robot velocity in the costmap prediction pipeline. We validate our method in multiple short and large-scale navigation tasks on a large, autonomous all-terrain vehicle (ATV) on challenging off-road terrains, and demonstrate ease of integration on a separate large ground robot. Our short-scale navigation results show that using our learned costmaps leads to overall smoother navigation, and provides the robot with a more fine-grained understanding of the interactions between the robot and different terrain types, such as grass and gravel. Our large-scale navigation trials show that we can reduce the number of interventions by up to 57% compared to an occupancy-based navigation baseline in challenging off-road courses ranging from 400 m to 3150 m.

Neural models are known to be over-parameterized, and recent work has shown that sparse text-to-speech (TTS) models can outperform dense models. Although a plethora of sparse methods has been proposed for other domains, such methods have rarely been applied in TTS. In this work, we seek to answer the question: what are the characteristics of selected sparse techniques on the performance and model complexity? We compare a Tacotron2 baseline and the results of applying five techniques. We then evaluate the performance via the factors of naturalness, intelligibility and prosody, while reporting model size and training time. Complementary to prior research, we find that pruning before or during training can achieve similar performance to pruning after training and can be trained much faster, while removing entire neurons degrades performance much more than removing parameters. To our best knowledge, this is the first work that compares sparsity paradigms in text-to-speech synthesis.

Given a graph or similarity matrix, we consider the problem of recovering a notion of true distance between the nodes, and so their true positions. We show that this can be accomplished in two steps: matrix factorisation, followed by nonlinear dimension reduction. This combination is effective because the point cloud obtained in the first step lives close to a manifold in which latent distance is encoded as geodesic distance. Hence, a nonlinear dimension reduction tool, approximating geodesic distance, can recover the latent positions, up to a simple transformation. We give a detailed account of the case where spectral embedding is used, followed by Isomap, and provide encouraging experimental evidence for other combinations of techniques.

While Reinforcement Learning (RL) aims to train an agent from a reward function in a given environment, Inverse Reinforcement Learning (IRL) seeks to recover the reward function from observing an expert's behavior. It is well known that, in general, various reward functions can lead to the same optimal policy, and hence, IRL is ill-defined. However, (Cao et al., 2021) showed that, if we observe two or more experts with different discount factors or acting in different environments, the reward function can under certain conditions be identified up to a constant. This work starts by showing an equivalent identifiability statement from multiple experts in tabular MDPs based on a rank condition, which is easily verifiable and is shown to be also necessary. We then extend our result to various different scenarios, i.e., we characterize reward identifiability in the case where the reward function can be represented as a linear combination of given features, making it more interpretable, or when we have access to approximate transition matrices. Even when the reward is not identifiable, we provide conditions characterizing when data on multiple experts in a given environment allows to generalize and train an optimal agent in a new environment. Our theoretical results on reward identifiability and generalizability are validated in various numerical experiments.

Graph-based multi-view clustering has achieved better performance than most non-graph approaches. However, in many real-world scenarios, the graph structure of data is not given or the quality of initial graph is poor. Additionally, existing methods largely neglect the high-order neighborhood information that characterizes complex intrinsic interactions. To tackle these problems, we introduce an approach called high-order multi-view clustering (HMvC) to explore the topology structure information of generic data. Firstly, graph filtering is applied to encode structure information, which unifies the processing of attributed graph data and non-graph data in a single framework. Secondly, up to infinity-order intrinsic relationships are exploited to enrich the learned graph. Thirdly, to explore the consistent and complementary information of various views, an adaptive graph fusion mechanism is proposed to achieve a consensus graph. Comprehensive experimental results on both non-graph and attributed graph data show the superior performance of our method with respect to various state-of-the-art techniques, including some deep learning methods.

Transformers are widely used in NLP, where they consistently achieve state-of-the-art performance. This is due to their attention-based architecture, which allows them to model rich linguistic relations between words. However, transformers are difficult to interpret. Being able to provide reasoning for its decisions is an important property for a model in domains where human lives are affected, such as hate speech detection and biomedicine. With transformers finding wide use in these fields, the need for interpretability techniques tailored to them arises. The effectiveness of attention-based interpretability techniques for transformers in text classification is studied in this work. Despite concerns about attention-based interpretations in the literature, we show that, with proper setup, attention may be used in such tasks with results comparable to state-of-the-art techniques, while also being faster and friendlier to the environment. We validate our claims with a series of experiments that employ a new feature importance metric.

Probabilistic models based on continuous latent spaces, such as variational autoencoders, can be understood as uncountable mixture models where components depend continuously on the latent code. They have proven expressive tools for generative and probabilistic modelling, but are at odds with tractable probabilistic inference, that is, computing marginals and conditionals of the represented probability distribution. Meanwhile, tractable probabilistic models such as probabilistic circuits (PCs) can be understood as hierarchical discrete mixture models, which allows them to perform exact inference, but often they show subpar performance in comparison to continuous latent-space models. In this paper, we investigate a hybrid approach, namely continuous mixtures of tractable models with a small latent dimension. While these models are analytically intractable, they are well amenable to numerical integration schemes based on a finite set of integration points. With a large enough number of integration points the approximation becomes de-facto exact. Moreover, using a finite set of integration points, the approximation method can be compiled into a PC performing `exact inference in an approximate model'. In experiments, we show that this simple scheme proves remarkably effective, as PCs learned this way set new state-of-the-art for tractable models on many standard density estimation benchmarks.

As a distributed learning paradigm, Federated Learning (FL) faces the communication bottleneck issue due to many rounds of model synchronization and aggregation. Heterogeneous data further deteriorates the situation by causing slow convergence. Although the impact of data heterogeneity on supervised FL has been widely studied, the related investigation for Federated Reinforcement Learning (FRL) is still in its infancy. In this paper, we first define the type and level of data heterogeneity for policy gradient based FRL systems. By inspecting the connection between the global and local objective functions, we prove that local training can benefit the global objective, if the local update is properly penalized by the total variation (TV) distance between the local and global policies. A necessary condition for the global policy to be learn-able from the local policy is also derived, which is directly related to the heterogeneity level. Based on the theoretical result, a Kullback-Leibler (KL) divergence based penalty is proposed, which, different from the conventional method that penalizes the model divergence in the parameter space, directly constrains the model outputs in the distribution space. Convergence proof of the proposed algorithm is also provided. By jointly penalizing the divergence of the local policy from the global policy with a global penalty and constraining each iteration of the local training with a local penalty, the proposed method achieves a better trade-off between training speed (step size) and convergence. Experiment results on two popular Reinforcement Learning (RL) experiment platforms demonstrate the advantage of the proposed algorithm over existing methods in accelerating and stabilizing the training process with heterogeneous data.

The model described in this paper belongs to the family of non-negative matrix factorization methods designed for data representation and dimension reduction. In addition to preserving the data positivity property, it aims also to preserve the structure of data during matrix factorization. The idea is to add, to the NMF cost function, a penalty term to impose a scale relationship between the pairwise similarity matrices of the original and transformed data points. The solution of the new model involves deriving a new parametrized update scheme for the coefficient matrix, which makes it possible to improve the quality of reduced data when used for clustering and classification. The proposed clustering algorithm is compared to some existing NMF-based algorithms and to some manifold learning-based algorithms when applied to some real-life datasets. The obtained results show the effectiveness of the proposed algorithm.

When Deep Neural Networks (DNNs) are used in safety-critical systems, engineers should determine the safety risks associated with failures (i.e., erroneous outputs) observed during testing. For DNNs processing images, engineers visually inspect all failure-inducing images to determine common characteristics among them. Such characteristics correspond to hazard-triggering events (e.g., low illumination) that are essential inputs for safety analysis. Though informative, such activity is expensive and error-prone. To support such safety analysis practices, we propose SEDE, a technique that generates readable descriptions for commonalities in failure-inducing, real-world images and improves the DNN through effective retraining. SEDE leverages the availability of simulators, which are commonly used for cyber-physical systems. It relies on genetic algorithms to drive simulators towards the generation of images that are similar to failure-inducing, real-world images in the test set; it then employs rule learning algorithms to derive expressions that capture commonalities in terms of simulator parameter values. The derived expressions are then used to generate additional images to retrain and improve the DNN. With DNNs performing in-car sensing tasks, SEDE successfully characterized hazard-triggering events leading to a DNN accuracy drop. Also, SEDE enabled retraining leading to significant improvements in DNN accuracy, up to 18 percentage points.

Existing detection methods commonly use a parameterized bounding box (BBox) to model and detect (horizontal) objects and an additional rotation angle parameter is used for rotated objects. We argue that such a mechanism has fundamental limitations in building an effective regression loss for rotation detection, especially for high-precision detection with high IoU (e.g. 0.75). Instead, we propose to model the rotated objects as Gaussian distributions. A direct advantage is that our new regression loss regarding the distance between two Gaussians e.g. Kullback-Leibler Divergence (KLD), can well align the actual detection performance metric, which is not well addressed in existing methods. Moreover, the two bottlenecks i.e. boundary discontinuity and square-like problem also disappear. We also propose an efficient Gaussian metric-based label assignment strategy to further boost the performance. Interestingly, by analyzing the BBox parameters' gradients under our Gaussian-based KLD loss, we show that these parameters are dynamically updated with interpretable physical meaning, which help explain the effectiveness of our approach, especially for high-precision detection. We extend our approach from 2-D to 3-D with a tailored algorithm design to handle the heading estimation, and experimental results on twelve public datasets (2-D/3-D, aerial/text/face images) with various base detectors show its superiority.  ( 3 min )

A widely used approach for extracting information from gene expression data employ the construction of a gene co-expression network and the subsequent application of algorithms that discover network structure. In particular, a common goal is the computational discovery of gene clusters, commonly called modules. When applied on a novel gene expression dataset, the quality of the computed modules can be evaluated automatically, using Gene Ontology enrichment, a method that measures the frequencies of Gene Ontology terms in the computed modules and evaluates their statistical likelihood. In this work we propose SGC a novel pipeline for gene clustering based on relatively recent seminal work in the mathematics of spectral network theory. SGC consists of multiple novel steps that enable the computation of highly enriched modules in an unsupervised manner. But unlike all existing frameworks, it further incorporates a novel step that leverages Gene Ontology information in a semi-supervised clustering method that further improves the quality of the computed modules. Comparing with already well-known existing frameworks, we show that SGC results in higher enrichment in real data. In particular, in 12 real gene expression datasets, SGC outperforms in all except one.  ( 2 min )

The COVID-19 pandemic dramatically catalyzed the proliferation of e-shopping. The dramatic growth of e-shopping will undoubtedly cause significant impacts on travel demand. As a result, transportation modeller's ability to model e-shopping demand is becoming increasingly important. This study developed models to predict household' weekly home delivery frequencies. We used both classical econometric and machine learning techniques to obtain the best model. It is found that socioeconomic factors such as having an online grocery membership, household members' average age, the percentage of male household members, the number of workers in the household and various land use factors influence home delivery demand. This study also compared the interpretations and performances of the machine learning models and the classical econometric model. Agreement is found in the variable's effects identified through the machine learning and econometric models. However, with similar recall accuracy, the ordered probit model, a classical econometric model, can accurately predict the aggregate distribution of household delivery demand. In contrast, both machine learning models failed to match the observed distribution.  ( 3 min )

We consider the task of detecting anomalies for autonomous mobile robots based on vision. We categorize relevant types of visual anomalies and discuss how they can be detected by unsupervised deep learning methods. We propose a novel dataset built specifically for this task, on which we test a state-of-the-art approach; we finally discuss deployment in a real scenario.  ( 2 min )

In this paper, we study the problem of recovering a low-rank matrix from a number of noisy random linear measurements. We consider the setting where the rank of the ground-truth matrix is unknown a prior and use an overspecified factored representation of the matrix variable, where the global optimal solutions overfit and do not correspond to the underlying ground-truth. We then solve the associated nonconvex problem using gradient descent with small random initialization. We show that as long as the measurement operators satisfy the restricted isometry property (RIP) with its rank parameter scaling with the rank of ground-truth matrix rather than scaling with the overspecified matrix variable, gradient descent iterations are on a particular trajectory towards the ground-truth matrix and achieve nearly information-theoretically optimal recovery when stop appropriately. We then propose an efficient early stopping strategy based on the common hold-out method and show that it detects nearly optimal estimator provably. Moreover, experiments show that the proposed validation approach can also be efficiently used for image restoration with deep image prior which over-parameterizes an image with a deep network.  ( 2 min )

Early sensory systems in the brain rapidly adapt to fluctuating input statistics, which requires recurrent communication between neurons. Mechanistically, such recurrent communication is often indirect and mediated by local interneurons. In this work, we explore the computational benefits of mediating recurrent communication via interneurons compared with direct recurrent connections. To this end, we consider two mathematically tractable recurrent neural networks that statistically whiten their inputs -- one with direct recurrent connections and the other with interneurons that mediate recurrent communication. By analyzing the corresponding continuous synaptic dynamics and numerically simulating the networks, we show that the network with interneurons is more robust to initialization than the network with direct recurrent connections in the sense that the convergence time for the synaptic dynamics in the network with interneurons (resp. direct recurrent connections) scales logarithmically (resp. linearly) with the spectrum of their initialization. Our results suggest that interneurons are computationally useful for rapid adaptation to changing input statistics. Interestingly, the network with interneurons is an overparameterized solution of the whitening objective for the network with direct recurrent connections, so our results can be viewed as a recurrent neural network analogue of the implicit acceleration phenomenon observed in overparameterized feedforward linear networks.  ( 3 min )

Multiclass probability estimation is the problem of estimating conditional probabilities of a data point belonging to a class given its covariate information. It has broad applications in statistical analysis and data science. Recently a class of weighted Support Vector Machines (wSVMs) has been developed to estimate class probabilities through ensemble learning for $K$-class problems (Wu, Zhang and Liu, 2010; Wang, Zhang and Wu, 2019), where $K$ is the number of classes. The estimators are robust and achieve high accuracy for probability estimation, but their learning is implemented through pairwise coupling, which demands polynomial time in $K$. In this paper, we propose two new learning schemes, the baseline learning and the One-vs-All (OVA) learning, to further improve wSVMs in terms of computational efficiency and estimation accuracy. In particular, the baseline learning has optimal computational complexity in the sense that it is linear in $K$. Though not being most efficient in computation, the OVA offers the best estimation accuracy among all the procedures under comparison. The resulting estimators are distribution-free and shown to be consistent. We further conduct extensive numerical experiments to demonstrate finite sample performance.  ( 2 min )

Bayesian optimisation (BO) algorithms have shown remarkable success in applications involving expensive black-box functions. Traditionally BO has been set as a sequential decision-making process which estimates the utility of query points via an acquisition function and a prior over functions, such as a Gaussian process. Recently, however, a reformulation of BO via density-ratio estimation (BORE) allowed reinterpreting the acquisition function as a probabilistic binary classifier, removing the need for an explicit prior over functions and increasing scalability. In this paper, we present a theoretical analysis of BORE's regret and an extension of the algorithm with improved uncertainty estimates. We also show that BORE can be naturally extended to a batch optimisation setting by recasting the problem as approximate Bayesian inference. The resulting algorithm comes equipped with theoretical performance guarantees and is assessed against other batch BO baselines in a series of experiments.  ( 2 min )

Contextual bandit and reinforcement learning algorithms have been successfully used in various interactive learning systems such as online advertising, recommender systems, and dynamic pricing. However, they have yet to be widely adopted in high-stakes application domains, such as healthcare. One reason may be that existing approaches assume that the underlying mechanisms are static in the sense that they do not change over different environments. In many real-world systems, however, the mechanisms are subject to shifts across environments which may invalidate the static environment assumption. In this paper, we take a step toward tackling the problem of environmental shifts considering the framework of offline contextual bandits. We view the environmental shift problem through the lens of causality and propose multi-environment contextual bandits that allow for changes in the underlying mechanisms. We adopt the concept of invariance from the causality literature and introduce the notion of policy invariance. We argue that policy invariance is only relevant if unobserved variables are present and show that, in that case, an optimal invariant policy is guaranteed to generalize across environments under suitable assumptions. Our results establish concrete connections among causality, invariance, and contextual bandits.  ( 3 min )

Probabilistic models based on continuous latent spaces, such as variational autoencoders, can be understood as uncountable mixture models where components depend continuously on the latent code. They have proven expressive tools for generative and probabilistic modelling, but are at odds with tractable probabilistic inference, that is, computing marginals and conditionals of the represented probability distribution. Meanwhile, tractable probabilistic models such as probabilistic circuits (PCs) can be understood as hierarchical discrete mixture models, which allows them to perform exact inference, but often they show subpar performance in comparison to continuous latent-space models. In this paper, we investigate a hybrid approach, namely continuous mixtures of tractable models with a small latent dimension. While these models are analytically intractable, they are well amenable to numerical integration schemes based on a finite set of integration points. With a large enough number of integration points the approximation becomes de-facto exact. Moreover, using a finite set of integration points, the approximation method can be compiled into a PC performing `exact inference in an approximate model'. In experiments, we show that this simple scheme proves remarkably effective, as PCs learned this way set new state-of-the-art for tractable models on many standard density estimation benchmarks.  ( 2 min )

We propose a goodness-of-fit test for degree-corrected stochastic block models (DCSBM). The test is based on an adjusted chi-square statistic for measuring equality of means among groups of $n$ multinomial distributions with $d_1,\dots,d_n$ observations. In the context of network models, the number of multinomials, $n$, grows much faster than the number of observations, $d_i$, corresponding to the degree of node $i$, hence the setting deviates from classical asymptotics. We show that a simple adjustment allows the statistic to converge in distribution, under null, as long as the harmonic mean of $\{d_i\}$ grows to infinity. When applied sequentially, the test can also be used to determine the number of communities. The test operates on a compressed version of the adjacency matrix, conditional on the degrees, and as a result is highly scalable to large sparse networks. We incorporate a novel idea of compressing the rows based on a $(K+1)$-community assignment when testing for $K$ communities. This approach increases the power in sequential applications without sacrificing computational efficiency, and we prove its consistency in recovering the number of communities. Since the test statistic does not rely on a specific alternative, its utility goes beyond sequential testing and can be used to simultaneously test against a wide range of alternatives outside the DCSBM family. In particular, we prove that the test is consistent against a general family of latent-variable network models with community structure.  ( 3 min )

Estimating individual treatment effects (ITEs) from observational data is relevant in many fields such as personalized medicine. However, in practice, the treatment assignment is usually confounded by unobserved variables and thus introduces bias. A remedy to remove the bias is the use of instrumental variables (IVs). Such settings are widespread in medicine (e.g., trials where compliance is used as binary IV). In this paper, we propose a novel, multiply robust machine learning framework, called MRIV, for estimating ITEs using binary IVs and thus yield an unbiased ITE estimator. Different from previous work for binary IVs, our framework estimates the ITE directly via a pseudo outcome regression. (1) We provide a theoretical analysis where we show that our framework yields multiply robust convergence rates: our ITE estimator achieves fast convergence even if several nuisance estimators converge slowly. (2) We further show that our framework asymptotically outperforms state-of-the-art plug-in IV methods for ITE estimation. (3) We build upon our theoretical results and propose a tailored deep neural network architecture called MRIV-Net for ITE estimation using binary IVs. Across various computational experiments, we demonstrate empirically that our MRIV-Net achieves state-of-the-art performance. To the best of our knowledge, our MRIV is the first machine learning framework for estimating ITEs in the binary IV setting shown to be multiply robust.  ( 3 min )

The cornerstone of neural algorithmic reasoning is the ability to solve algorithmic tasks, especially in a way that generalises out of distribution. While recent years have seen a surge in methodological improvements in this area, they mostly focused on building specialist models. Specialist models are capable of learning to neurally execute either only one algorithm or a collection of algorithms with identical control-flow backbone. Here, instead, we focus on constructing a generalist neural algorithmic learner -- a single graph neural network processor capable of learning to execute a wide range of algorithms, such as sorting, searching, dynamic programming, path-finding and geometry. We leverage the CLRS benchmark to empirically show that, much like recent successes in the domain of perception, generalist algorithmic learners can be built by "incorporating" knowledge. That is, it is possible to effectively learn algorithms in a multi-task manner, so long as we can learn to execute them well in a single-task regime. Motivated by this, we present a series of improvements to the input representation, training regime and processor architecture over CLRS, improving average single-task performance by over 20% from prior art. We then conduct a thorough ablation of multi-task learners leveraging these improvements. Our results demonstrate a generalist learner that effectively incorporates knowledge captured by specialist models.  ( 3 min )

Subseasonal forecasting $\unicode{x2013}$ predicting temperature and precipitation 2 to 6 weeks $\unicode{x2013}$ ahead is critical for effective water allocation, wildfire management, and drought and flood mitigation. Recent international research efforts have advanced the subseasonal capabilities of operational dynamical models, yet temperature and precipitation prediction skills remains poor, partly due to stubborn errors in representing atmospheric dynamics and physics inside dynamical models. To counter these errors, we introduce an adaptive bias correction (ABC) method that combines state-of-the-art dynamical forecasts with observations using machine learning. When applied to the leading subseasonal model from the European Centre for Medium-Range Weather Forecasts (ECMWF), ABC improves temperature forecasting skill by 60-90% and precipitation forecasting skill by 40-69% in the contiguous U.S. We couple these performance improvements with a practical workflow, based on Cohort Shapley, for explaining ABC skill gains and identifying higher-skill windows of opportunity based on specific climate conditions.  ( 2 min )

Boosting is a celebrated machine learning approach which is based on the idea of combining weak and moderately inaccurate hypotheses to a strong and accurate one. We study boosting under the assumption that the weak hypotheses belong to a class of bounded capacity. This assumption is inspired by the common convention that weak hypotheses are "rules-of-thumbs" from an "easy-to-learn class". (Schapire and Freund~'12, Shalev-Shwartz and Ben-David '14.) Formally, we assume the class of weak hypotheses has a bounded VC dimension. We focus on two main questions: (i) Oracle Complexity: How many weak hypotheses are needed to produce an accurate hypothesis? We design a novel boosting algorithm and demonstrate that it circumvents a classical lower bound by Freund and Schapire ('95, '12). Whereas the lower bound shows that $\Omega({1}/{\gamma^2})$ weak hypotheses with $\gamma$-margin are sometimes necessary, our new method requires only $\tilde{O}({1}/{\gamma})$ weak hypothesis, provided that they belong to a class of bounded VC dimension. Unlike previous boosting algorithms which aggregate the weak hypotheses by majority votes, the new boosting algorithm uses more complex ("deeper") aggregation rules. We complement this result by showing that complex aggregation rules are in fact necessary to circumvent the aforementioned lower bound. (ii) Expressivity: Which tasks can be learned by boosting weak hypotheses from a bounded VC class? Can complex concepts that are "far away" from the class be learned? Towards answering the first question we {introduce combinatorial-geometric parameters which capture expressivity in boosting.} As a corollary we provide an affirmative answer to the second question for well-studied classes, including half-spaces and decision stumps. Along the way, we establish and exploit connections with Discrepancy Theory.  ( 3 min )

Epilepsy is one of the most common neurological diseases, characterized by transient and unprovoked events called epileptic seizures. Electroencephalogram (EEG) is an auxiliary method used to perform both the diagnosis and the monitoring of epilepsy. Given the unexpected nature of an epileptic seizure, its prediction would improve patient care, optimizing the quality of life and the treatment of epilepsy. Predicting an epileptic seizure implies the identification of two distinct states of EEG in a patient with epilepsy: the preictal and the interictal. In this paper, we developed two deep learning models called Temporal Multi-Channel Transformer (TMC-T) and Vision Transformer (TMC-ViT), adaptations of Transformer-based architectures for multi-channel temporal signals. Moreover, we accessed the impact of choosing different preictal duration, since its length is not a consensus among experts, and also evaluated how the sample size benefits each model. Our models are compared with fully connected, convolutional, and recurrent networks. The algorithms were patient-specific trained and evaluated on raw EEG signals from the CHB-MIT database. Experimental results and statistical validation demonstrated that our TMC-ViT model surpassed the CNN architecture, state-of-the-art in seizure prediction.  ( 3 min )

The core principle of Variational Inference (VI) is to convert the statistical inference problem of computing complex posterior probability densities into a tractable optimization problem. This property enables VI to be faster than several sampling-based techniques. However, the traditional VI algorithm is not scalable to large data sets and is unable to readily infer out-of-bounds data points without re-running the optimization process. Recent developments in the field, like stochastic-, black box- and amortized-VI, have helped address these issues. Generative modeling tasks nowadays widely make use of amortized VI for its efficiency and scalability, as it utilizes a parameterized function to learn the approximate posterior density parameters. With this paper, we review the mathematical foundations of various VI techniques to form the basis for understanding amortized VI. Additionally, we provide an overview of the recent trends that address several issues of amortized VI, such as the amortization gap, generalization issues, inconsistent representation learning, and posterior collapse. Finally, we analyze alternate divergence measures that improve VI optimization.  ( 2 min )

Benchmarks for the evaluation of model performance play an important role in machine learning. However, there is no established way to describe and create new benchmarks. What is more, the most common benchmarks use performance measures that share several limitations. For example, the difference in performance for two models has no probabilistic interpretation, there is no reference point to indicate whether they represent a significant improvement, and it makes no sense to compare such differences between data sets. We introduce a new meta-score assessment named Elo-based Predictive Power (EPP) that is built on top of other performance measures and allows for interpretable comparisons of models. The differences in EPP scores have a probabilistic interpretation and can be directly compared between data sets, furthermore, the logistic regression-based design allows for an assessment of ranking fitness based on a deviance statistic. We prove the mathematical properties of EPP and support them with empirical results of a large scale benchmark on 30 classification data sets and a real-world benchmark for visual data. Additionally, we propose a Unified Benchmark Ontology that is used to give a uniform description of benchmarks.  ( 3 min )

We study norm-based uniform convergence bounds for neural networks, aiming at a tight understanding of how these are affected by the architecture and type of norm constraint, for the simple class of scalar-valued one-hidden-layer networks, and inputs bounded in Euclidean norm. We begin by proving that in general, controlling the spectral norm of the hidden layer weight matrix is insufficient to get uniform convergence guarantees (independent of the network width), while a stronger Frobenius norm control is sufficient, extending and improving on previous work. Motivated by the proof constructions, we identify and analyze two important settings where (perhaps surprisingly) a mere spectral norm control turns out to be sufficient: First, when the network's activation functions are sufficiently smooth (with the result extending to deeper networks); and second, for certain types of convolutional networks. In the latter setting, we study how the sample complexity is additionally affected by parameters such as the amount of overlap between patches and the overall number of patches.  ( 2 min )

Given a graph or similarity matrix, we consider the problem of recovering a notion of true distance between the nodes, and so their true positions. We show that this can be accomplished in two steps: matrix factorisation, followed by nonlinear dimension reduction. This combination is effective because the point cloud obtained in the first step lives close to a manifold in which latent distance is encoded as geodesic distance. Hence, a nonlinear dimension reduction tool, approximating geodesic distance, can recover the latent positions, up to a simple transformation. We give a detailed account of the case where spectral embedding is used, followed by Isomap, and provide encouraging experimental evidence for other combinations of techniques.  ( 2 min )

Learned optimizers -- neural networks that are trained to act as optimizers -- have the potential to dramatically accelerate training of machine learning models. However, even when meta-trained across thousands of tasks at huge computational expense, blackbox learned optimizers often struggle with stability and generalization when applied to tasks unlike those in their meta-training set. In this paper, we use tools from dynamical systems to investigate the inductive biases and stability properties of optimization algorithms, and apply the resulting insights to designing inductive biases for blackbox optimizers. Our investigation begins with a noisy quadratic model, where we characterize conditions in which optimization is stable, in terms of eigenvalues of the training dynamics. We then introduce simple modifications to a learned optimizer's architecture and meta-training procedure which lead to improved stability, and improve the optimizer's inductive bias. We apply the resulting learned optimizer to a variety of neural network training tasks, where it outperforms the current state of the art learned optimizer -- at matched optimizer computational overhead -- with regard to optimization performance and meta-training speed, and is capable of generalization to tasks far different from those it was meta-trained on.  ( 2 min )

A clustering outcome for high-dimensional data is typically interpreted via post-processing, involving dimension reduction and subsequent visualization. This destroys the meaning of the data and obfuscates interpretations. We propose algorithm-agnostic interpretation methods to explain clustering outcomes in reduced dimensions while preserving the integrity of the data. The permutation feature importance for clustering represents a general framework based on shuffling feature values and measuring changes in cluster assignments through custom score functions. The individual conditional expectation for clustering indicates observation-wise changes in the cluster assignment due to changes in the data. The partial dependence for clustering evaluates average changes in cluster assignments for the entire feature space. All methods can be used with any clustering algorithm able to reassign instances through soft or hard labels. In contrast to common post-processing methods such as principal component analysis, the introduced methods maintain the original structure of the features.  ( 2 min )

We present a Gaussian Process (GP) approach (Gaussian Process Hydrodynamics, GPH) for solving the Euler and Navier-Stokes equations. As in Smoothed Particle Hydrodynamics (SPH), GPH is a Lagrangian particle-based approach involving the tracking of a finite number of particles transported by the flow. However, these particles do not represent mollified particles of matter but carry discrete/partial information about the continuous flow. Closure is achieved by placing a divergence-free GP prior $\xi$ on the velocity field and conditioning on vorticity at particle locations. Known physics (e.g., the Richardson cascade and velocity-increments power laws) is incorporated into the GP prior through physics-informed additive kernels. This is equivalent to expressing $\xi$ as a sum of independent GPs $\xi^l$, which we call modes, acting at different scales. This approach leads to a quantitative analysis of the Richardson cascade through the analysis of the activation of these modes and allows us to coarse-grain turbulence in a statistical manner rather than a deterministic one. Since GPH is formulated on the vorticity equations, it does not require solving a pressure equation. By enforcing incompressibility and fluid/structure boundary conditions through the selection of the kernel, GPH requires much fewer particles than SPH. Since GPH has a natural probabilistic interpretation, numerical results come with uncertainty estimates enabling their incorporation into a UQ pipeline and the adding/removing of particles in an adapted manner. The proposed approach is amenable to analysis, it inherits the complexity of state-of-the-art solvers for dense kernel matrices, and it leads to a natural definition of turbulence as information loss. Numerical experiments support the importance of selecting physics-informed kernels and illustrate the major impact of such kernels on accuracy and stability.  ( 3 min )

This paper introduces a new simulation-based inference procedure to model and sample from multi-dimensional probability distributions given access to i.i.d.\ samples, circumventing the usual approaches of explicitly modeling the density function or designing Markov chain Monte Carlo. Motivated by the seminal work on distance and isomorphism between metric measure spaces, we propose a new notion called the Reversible Gromov-Monge (RGM) distance and study how RGM can be used to design new transform samplers to perform simulation-based inference. Our RGM sampler can also estimate optimal alignments between two heterogeneous metric measure spaces $(\cX, \mu, c_{\cX})$ and $(\cY, \nu, c_{\cY})$ from empirical data sets, with estimated maps that approximately push forward one measure $\mu$ to the other $\nu$, and vice versa. We study the analytic properties of the RGM distance and derive that under mild conditions, RGM equals the classic Gromov-Wasserstein distance. Curiously, drawing a connection to Brenier's polar factorization, we show that the RGM sampler induces bias towards strong isomorphism with proper choices of $c_{\cX}$ and $c_{\cY}$. Statistical rate of convergence, representation, and optimization questions regarding the induced sampler are studied. Synthetic and real-world examples showcasing the effectiveness of the RGM sampler are also demonstrated.  ( 3 min )

Understanding black-box machine learning models is crucial for their widespread adoption. Learning globally interpretable models is one approach, but achieving high performance with them is challenging. An alternative approach is to explain individual predictions using locally interpretable models. For locally interpretable modeling, various methods have been proposed and indeed commonly used, but they suffer from low fidelity, i.e. their explanations do not approximate the predictions well. In this paper, our goal is to push the state-of-the-art in high-fidelity locally interpretable modeling. We propose a novel framework, Locally Interpretable Modeling using Instance-wise Subsampling (LIMIS). LIMIS utilizes a policy gradient to select a small number of instances and distills the black-box model into a low-capacity locally interpretable model using those selected instances. Training is guided with a reward obtained directly by measuring the fidelity of the locally interpretable models. We show on multiple tabular datasets that LIMIS near-matches the prediction accuracy of black-box models, significantly outperforming state-of-the-art locally interpretable models in terms of fidelity and prediction accuracy.  ( 2 min )

Due to the subtle balance of intermolecular interactions that govern structure-property relations, predicting the stability of crystal structures formed from molecular building blocks is a highly non-trivial scientific problem. A particularly active and fruitful approach involves classifying the different combinations of interacting chemical moieties, as understanding the relative energetics of different interactions enables the design of molecular crystals and fine-tuning their stabilities. While this is usually performed based on the empirical observation of the most commonly encountered motifs in known crystal structures, we propose to apply a combination of supervised and unsupervised machine-learning techniques to automate the construction of an extensive library of molecular building blocks. We introduce a structural descriptor tailored to the prediction of the binding energy for a curated dataset of organic crystals and exploit its atom-centered nature to obtain a data-driven assessment of the contribution of different chemical groups to the lattice energy of the crystal. We then interpret this library using a low-dimensional representation of the structure-energy landscape and discuss selected examples of the insights that can be extracted from this analysis, providing a complete database to guide the design of molecular materials.  ( 2 min )

Instrumental variable models allow us to identify a causal function between covariates $X$ and a response $Y$, even in the presence of unobserved confounding. Most of the existing estimators assume that the error term in the response $Y$ and the hidden confounders are uncorrelated with the instruments $Z$. This is often motivated by a graphical separation, an argument that also justifies independence. Positing an independence restriction, however, leads to strictly stronger identifiability results. We connect to the existing literature in econometrics and provide a practical method called HSIC-X for exploiting independence that can be combined with any gradient-based learning procedure. We see that even in identifiable settings, taking into account higher moments may yield better finite sample results. Furthermore, we exploit the independence for distribution generalization. We prove that the proposed estimator is invariant to distributional shifts on the instruments and worst-case optimal whenever these shifts are sufficiently strong. These results hold even in the under-identified case where the instruments are not sufficiently rich to identify the causal function.  ( 2 min )

This paper presents recent methodological advances to perform simulation-based inference (SBI) of a general class of Bayesian hierarchical models (BHMs), while checking for model misspecification. Our approach is based on a two-step framework. First, the latent function that appears as second layer of the BHM is inferred and used to diagnose possible model misspecification. Second, target parameters of the trusted model are inferred via SBI. Simulations used in the first step are recycled for score compression, which is necessary to the second step. As a proof of concept, we apply our framework to a prey-predator model built upon the Lotka-Volterra equations and involving complex observational processes.  ( 2 min )

Would love for this community to check it out and give us your feedback, it's 100% free to use and create an account: https://consensus.app/search/ You can ask any plain English research question and we will use language models to try to find relevant findings in research papers. Here's an example: Does Magnesium help with sleep? submitted by /u/EOlson76 [link] [comments]  ( 103 min )

I'm trying to build a post success prediction, which basically tells u if your post will succeed (get alot of upvotes) or not, i was thinking of BERT but i dont want tp be mistaken, is my choice correct? For dataset i will provide reddit post title + upvotes submitted by /u/Yuuki__konno [link] [comments]  ( 88 min )

Hi all I am working on a project where I fine-tuned a Pegasus model on the Reddit dataset. Now, I need to convert the fine-tuned model to ONNX for the deployment stage. I have followed this guide from Huggingface to convert to the ONNX model for unsupported architects. I got it done but the ONNX model can't generate text. Turned out that Pegasus is an encoder-decoder model and most guides are for either encoder-model (e.g. BERT) or decoder-model (e.g. GPT2). I found the only example of converting an encoder-decoder model to ONNX from here https://github.com/Ki6an/fastT5. My question is if someone has experienced or seen the Pegasus model being converted to ONNX in the wild. Or do you have any tips/hints to do so? Thanks so much in advance submitted by /u/Lost-Letterhead2105 [link] [comments]  ( 89 min )

Hey guys! I ran a few benchmarks on Whisper's runtime and cost-to-run on GCP, so just dropping it here in case it's valuable to anyone! submitted by /u/SleekEagle [link] [comments]  ( 89 min )

I'm looking for papers dealing with document understanding for long documents, when I say long I mean an article (~10 pages) or even a full book. I'm would like to perform summarization or question-answering for such documents, but it seems that most literature never get to such document length. Do you know articles or do you have advice on how to use typical NLP-models for book-size inputs ? The easy solution would be to chunk the large document into smaller parts, but it seems to me that such approach would lose some semantics about the original text (i.e. if you split the text at the wrong place, it could change the meaning of the text), moreover since each chunk is processed independently, you lose context which be important to important a specific chunk submitted by /u/Even_Information4853 [link] [comments]  ( 91 min )

Hi everyone, my background is mainly focused in Computer Vision/Image processing. I want to start delve more into NLP, as I’ve never really went further than the basic concepts and I feel like very interesting CV ideas recently stem from the intersection of the two. What NLP papers are in your opinion must-read? submitted by /u/ats678 [link] [comments]  ( 88 min )

Hi, I am interested in the task of text generation for HR purposes. Right now, using GPT3 I can get decent results by prompting it with "3 sentences with negative feedback about Mary with the words "bad-tempered", "tardiness" and "needs improvement"." It does generate a decent negative "feedback" about Mary. Question : Is there anything out there that is open-sourced that can match this capability? submitted by /u/lppier2 [link] [comments]  ( 89 min )

The Data Science Interview book is a completely online and free resource which has been making steady progress over the months. In the last 1 year it has been used by readers of more than 90 countries. Be sure to check it out. Recently we have launched a 📖 PDF version of the book at a launch price of $5 🥳, with a commitment that all future releases of the book will be mailed to the purchasers. The proceedings of this will be used to MAINTAIN and keep the online version FREE Don't forget to show this project your ❤️ and support submitted by /u/dipranjanchatterjee [link] [comments]  ( 90 min )

Semantic graphs, also known as knowledge graphs or semantic networks, build a graph network with semantic relationships connecting the nodes. They can be used to explore topics, data connectivity and perform network analysis. One interesting application is path traversal to analyze the connectivity of a dataset. These semantic relationships can be between text, audio and/or images. Here is an illustration that traces how two sentences are connected in the ag_news dataset. https://preview.redd.it/cv7wzjdkgbp91.png?width=1268&format=png&auto=webp&s=6235f4f27280397da92f725418d237adba432187 The illustration above demonstrates how a graph's relationships are used to walk a path between two totally unrelated snippets of text. This idea isn't exclusive to text, the same can be done for images. See this example from the imagenette dataset. https://preview.redd.it/5onn0d33hbp91.png?width=1482&format=png&auto=webp&s=5b15e7de0f61868370021126da3b18e9bc22a120 This path is starting with a person parachuting and uses the semantic graph's relationships to walk a path to a picture of a person holding a french horn. In addition to being highly interesting, this is also useful in helping with Exploratory Data Analysis (EDA). Full article and code can be found at the links below. Article: https://neuml.hashnode.dev/introducing-the-semantic-graph GitHub: https://github.com/neuml/txtai submitted by /u/davidmezzetti [link] [comments]  ( 89 min )

Hey r/MachineLearning, just had a thought come to mind as I stare at my powerful gaming PC currently going unused. With its powerful 3080ti graphics card, intel i9, and tons of RAM, I was wondering if there's a way I could put this fella to work, earn a few $ a day, and maybe help some machine learning researchers train their models. Are there any turn-key solutions/providers that help facilitate this? Or any other advice for doing something like this? Thanks for any guidance, cheers submitted by /u/RealSonZoo [link] [comments]  ( 89 min )

submitted by /u/Rawchaa [link] [comments]  ( 87 min )

The goal of blind face restoration is to recover high-quality images of human faces from their low-quality counterparts that have been degraded for an unknown reason. Some degradation causes could be noise, blur, low-resolution, and compression artifacts. In this work, researchers from the Applied Research Center of the Tencent company propose GFP-GAN, a Generative Facial Prior GAN for real-world blind face restoration. As it is possible to see in Figure 1, the images restored through GFP-GAN reach higher realness and fidelity with fewer artifacts. Continue reading | Check out the paper and github link. ​ https://preview.redd.it/vvss7n3lnhp91.png?width=1045&format=png&auto=webp&s=8fd0c5ffae078a9aae3ec978caacc898d050bd1a submitted by /u/ai-lover [link] [comments]  ( 87 min )

I've learned a lot about AI applications by using other people's Google Colab notebooks. When OpenAI's Whisper arrived, I created a Google Colab notebook so you can run both the transcription and translation functions of this automatic speech recognition system. submitted by /u/ZackaryBlue [link] [comments]  ( 87 min )

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hello, i am currently enrolled in a BSc of artificial intelligence, I'd like to know what if there are some courses online were i can earn a certificate to boost my CV when i am applying to jobs. note: preferably on coursera, but i dont mind better options if available. submitted by /u/Lebanese-dude [link] [comments]  ( 87 min )

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Hey everyone! I'm sure many of you know that OpenAI released Whisper yesterday- an open source speech recognition model with weights available. Not sure if this is allowed, but I wrote a guide on how to run Whisper that also provides some benchmarks on accuracy, inference time, and cost. Let me know what you think :) submitted by /u/SleekEagle [link] [comments]  ( 87 min )

submitted by /u/TallAssociation0 [link] [comments]  ( 92 min )

Data-centric AI doesn't just stop with cleaning and preparing data for model training - there are rich insights to be gleaned from production data. By analyzing, segmenting, and selectively relabeling your production inference data, you can generate datasets for future model retraining. This talk will show you how you can use human-in-the-loop oversight to generate high-quality, labeled datasets using Label Studio from your prediction data for future model retraining. Tune in to the Modzy Discord Server today at 12:30 EDT! submitted by /u/modzykirsten [link] [comments]  ( 87 min )

submitted by /u/Black_RL [link] [comments]  ( 93 min )

For some reason, this program is super slow. I have spent quite a while, trying to debug it. However, it doesn't seem different from other keras programs that are much faster. ​ ***Update - I think I know where the problem is. After analyzing other programs, it seems that this code cannot perform batch operations quickly. Most, batch operations are performed in the replay method. ​ # -*- coding: utf-8 -*- import random import gym import numpy as np from collections import deque from keras.models import Sequential from keras.layers import Dense from tensorflow.keras.optimizers import Adam from keras import backend as K import time import tensorflow as tf EPISODES = 5000 class DQNAgent: def __init__(self, state_size, action_size): self.state_size = state_size self.action_size = action_s…  ( 90 min )

I have completed several courses on data science, machine learning and deep learning. The thing that interested me the most was reinforcement learning. The idea of ​​building an AI that learns to play an arcade game looks good. But since this will be my final project, I thought something that could be used in real life would be better. For example, what problem does an artificial intelligence learn to play Mario solve in real life? Do you have any such project suggestions? Fun, impressive and simple. :) submitted by /u/Long_Elk_4215 [link] [comments]  ( 100 min )

What are the prerequisites for David's silver RL playlist? And should I use that because there are 2 other playlists in deep mind from Hado van Hasselt? One was released in 2018 and other on 2021. Which one should I follow at the beginning of the journey? And what are the prerequisites for all that? submitted by /u/Cosmic_Ishan [link] [comments]  ( 88 min )

Assume a Batch-RL(BRL) agent learns from an expert buffer generated AFTER an RL agent trained online for a large number of iterations (e.g. 1M). Thus, the buffer should contain only transitions with high returns. Essentially, this BRL agent is not the same as the expert agent since it has no knowledge of what state-action pairs would lead to low returns. So the differences between this BRL agent and the expert agent are the regime where state-action visitations are learned and of course the parameters in the neural networks. I assume there is also a difference similar to the credit/blame assignment since there might be slim to no blame assignment in the BRL agent. My question is that intuitively a BRL model would be more robust if it trains on both expert and replay buffers (similar to what COMBO did). But how do I prove it? submitted by /u/Blasphemer666 [link] [comments]  ( 88 min )

I am using Deep Q Learning to try to create a simple 2D self driving car simulation in Python. The state is the distance to the edge of the road at a few locations, and the actions are left, right, accelerate, brake. When simply controlling steering, it can navigate any map, but introduced to speed, it can't learn to brake around corners, causing it to crash. I have tried alot of different combinations of hyperparameters, and the below graph is the best I can get it. ​ https://preview.redd.it/36xatmkwifp91.png?width=564&format=png&auto=webp&s=0786ecc010ee7913513cad35fb4042902011f4a6 Here are the settings I used. "LEARNING_RATE": 1e-10, "GD_MOMENTUM": 0.9, "DISCOUNT_RATE": 0.999, "EPSILON_DECAY": 0.00002, "EPSILON_MIN": 0.1, "TARGET_NET_COPY_STEPS": 17000, "TRAIN_AMOUNT": 0.8, My guess is that it can't take into account rewards that far in the future, so I increased the movement per frame but it didn't help. For the neural networks, I am using my own library (which I have verified works), with 12 layers, increasing up to a max of 256 nodes, using relu. I have tried different configurations, which were either worse or the same. You can find the code here, but there is alot of code for other features, so it may be confusing. I can confirm it works, at least for steering.: Github Thanks for any advice! submitted by /u/Si1veRonReddit [link] [comments]  ( 92 min )

Hello. I'm working on a masters thesis in engineering where I'm deploying a deep RL agent on a simulation I made. I have hit a brick wall in formulating my reward signal it seems. So some actions the agent can take may not have any consequences until many states later, 50-100 even so I'm fearing that might cause divergence in the learning process but if I formulate the reward differently the agent might not learn the desired mechanics of the simulation. Am I overthinking this or is this a legitimate concern for deep RL in general? Thanks a lot in advance! P.s. Sorry for not explaining a whole lot, I thought I'd present the problem broadly but if you're interested to know what the simulation is about please dm me! submitted by /u/arachnarus96 [link] [comments]  ( 112 min )

What is the roadmap I need to follow to learn deep reinforcement learning> What is the best course for learning "deep reinforcement learning"? ​ I show deep mind has some playlist for it but they don't teach the implementation. Anywhere I could learn the implementation? submitted by /u/Cosmic_Ishan [link] [comments]  ( 90 min )

Our research group currently add a new direction to use RL to solve job shop problems(one of NP-hard problems). Spent some days learning and practicing, we decide to buy a server to train model remotely. However we do not have much experience about hardwares, so we are just confused about which (CPU / GPU / Ram / Mainboard / Memory / Nic) will be good for us. In our project, images are rarely involved, so I guess maybe we don't need a GPU with high performance. In conclude, we need a server to : - support 2 - 3 persons to train RL models at the same time, - focus on training without image processing. I will be very grateful if you can give me some precious advice. And by the way, I have little knowledge about configuring remote server, like install Linux system, establish ssh connect, manage user group ... So I also need some tutorials about this. submitted by /u/JoPrimer [link] [comments]  ( 90 min )

Posted by Jeremy Maitin-Shepard and Laramie Leavitt, Software Engineers, Connectomics at Google Many exciting contemporary applications of computer science and machine learning (ML) manipulate multidimensional datasets that span a single large coordinate system, for example, weather modeling from atmospheric measurements over a spatial grid or medical imaging predictions from multi-channel image intensity values in a 2d or 3d scan. In these settings, even a single dataset may require terabytes or petabytes of data storage. Such datasets are also challenging to work with as users may read and write data at irregular intervals and varying scales, and are often interested in performing analyses using numerous machines working in parallel. Today we are introducing TensorStore, an open-source…  ( 26 min )

Our planet faces a global extinction crisis. UN Report shows a staggering number of more than a million species feared to be on the path of extinction. The most common reasons for extinction include loss of habitat, poaching, and invasive species. Several wildlife conservation foundations, research scientists, volunteers, and anti-poaching rangers have been working tirelessly […]  ( 8 min )

Amazon’s product search engine indexes billions of products, serves hundreds of millions of customers worldwide, and is one of the most heavily used services in the world. The Amazon Search team develops machine learning (ML) technology that powers the Amazon.com search engine and helps customers search effortlessly. To deliver a great customer experience and operate […]  ( 7 min )

submitted by /u/Ziinxx [link] [comments]  ( 86 min )

Hi, I've been trying to learn about neural networks recently and I successfully coded a neural network from scratch to recognize digits from the MNIST database. I'm now trying to create a more advanced neural network and I would be grateful if someone would give me some advice about the architectural structure of the network. Let's assume that I am trying to build a neural network that is trying to predict a plant's height based on a variety of inputs. Some of the inputs would be things such as days alive, current height, etc. However, another type of inputs would be the width, length, and thickness of each leaf that the plant has. Because different plants will have different amounts of leaves and the width, length, and thickness of each leaf are correlated and not standalone inputs, I was wondering how this network would be designed. So far, I have done initial research about RNNs or LSTMs but I am not sure how these would solve the problem of finding a way to keep the width, length, and thickness of each leaf correlated to each other. Could somebody please point me in the right direction or tell me what architectures I should look into? submitted by /u/Ceraphen [link] [comments]  ( 104 min )

When it rains, it pours. And this GFN Thursday brings a downpour of news for GeForce NOW members. The Logitech G CLOUD is the latest gaming handheld device to support GeForce NOW, giving members a brand new way to keep the gaming going. But that’s not all: Portal with RTX joins GeForce NOW in November, Read article > The post Go Hands On: Logitech G CLOUD Launches With Support for GeForce NOW appeared first on NVIDIA Blog.  ( 6 min )

Autonomous vehicle sensors require the same rigorous testing and validation as the car itself, and one simulation platform is up to the task. Global tier-1 supplier Continental and software-defined lidar maker AEye announced this week at NVIDIA GTC that they will migrate their intelligent lidar sensor model into NVIDIA DRIVE Sim. The companies are the Read article > The post Continental and AEye Join NVIDIA DRIVE Sim Sensor Ecosystem, Providing Rich Capabilities for AV Development appeared first on NVIDIA Blog.  ( 5 min )

I was spelunking around in Unicode and found that there are assigned characters for representing domino tiles and that the characters are enumerated in a convenient order. Here is the code chart. There are codes for representing tiles horizontally or vertically. And even though, for example, the 5-3 is the same domino as the 3-5, […] Dominoes in Unicode first appeared on John D. Cook.  ( 5 min )

How much will it cost to hire a custom software development company or an app developer in 2022? If this question strikes your mind, you’re at the right place.  With the increasing trend of digitization, many businesses are paving the way to bring digital transformation to their operations. However, they remain confused about evaluating the… Read More »How Much Does It Cost to Hire a Software Developer? The post How Much Does It Cost to Hire a Software Developer? appeared first on Data Science Central.  ( 20 min )

Federated Learning (FL) is a machine learning paradigm that allows decentralized clients to learn collaboratively without sharing their private data. However, excessive computation and communication demands pose challenges to current FL frameworks, especially when training large-scale models. To prevent these issues from hindering the deployment of FL systems, we propose a lightweight framework where clients jointly learn to fuse the representations generated by multiple fixed pre-trained models rather than training a large-scale model from scratch. This leads us to a more practical FL problem by considering how to capture more client-specific and class-relevant information from the pre-trained models and jointly improve each client's ability to exploit those off-the-shelf models. In this work, we design a Federated Prototype-wise Contrastive Learning (FedPCL) approach which shares knowledge across clients through their class prototypes and builds client-specific representations in a prototype-wise contrastive manner. Sharing prototypes rather than learnable model parameters allows each client to fuse the representations in a personalized way while keeping the shared knowledge in a compact form for efficient communication. We perform a thorough evaluation of the proposed FedPCL in the lightweight framework, measuring and visualizing its ability to fuse various pre-trained models on popular FL datasets.

Developing new drugs for target diseases is a time-consuming and expensive task, drug repurposing has become a popular topic in the drug development field. As much health claim data become available, many studies have been conducted on the data. The real-world data is noisy, sparse, and has many confounding factors. In addition, many studies have shown that drugs effects are heterogeneous among the population. Lots of advanced machine learning models about estimating heterogeneous treatment effects (HTE) have emerged in recent years, and have been applied to in econometrics and machine learning communities. These studies acknowledge medicine and drug development as the main application area, but there has been limited translational research from the HTE methodology to drug development. We aim to introduce the HTE methodology to the healthcare area and provide feasibility consideration when translating the methodology with benchmark experiments on healthcare administrative claim data. Also, we want to use benchmark experiments to show how to interpret and evaluate the model when it is applied to healthcare research. By introducing the recent HTE techniques to a broad readership in biomedical informatics communities, we expect to promote the wide adoption of causal inference using machine learning. We also expect to provide the feasibility of HTE for personalized drug effectiveness.

The learning of the simplest possible computational pattern -- periodicity -- is an open problem in the research of strong generalisation in neural networks. We formalise the problem of extrapolative generalisation for periodic signals and systematically investigate the generalisation abilities of classical, population-based, and recently proposed periodic architectures on a set of benchmarking tasks. We find that periodic and "snake" activation functions consistently fail at periodic extrapolation, regardless of the trainability of their periodicity parameters. Further, our results show that traditional sequential models still outperform the novel architectures designed specifically for extrapolation, and that these are in turn trumped by population-based training. We make our benchmarking and evaluation toolkit, PerKit, available and easily accessible to facilitate future work in the area.

We study a single-server scheduling problem for the objective of minimizing the expected cumulative holding cost incurred by jobs, where parameters defining stochastic job holding costs are unknown to the scheduler. We consider a general setting allowing for different job classes, where jobs of the same class have statistically identical holding costs and service times, with an arbitrary number of jobs across classes. In each time step, the server can process a job and observes random holding costs of the jobs that are yet to be completed. We consider a learning-based $c\mu$ rule scheduling which starts with a preemption period of fixed duration, serving as a learning phase, and having gathered data about jobs, it switches to nonpreemptive scheduling. Our algorithms are designed to handle instances with large and small gaps in mean job holding costs and achieve near-optimal performance guarantees. The performance of algorithms is evaluated by regret, where the benchmark is the minimum possible total holding cost attained by the $c\mu$ rule scheduling policy when the parameters of jobs are known. We show regret lower bounds and algorithms that achieve nearly matching regret upper bounds. Our numerical results demonstrate the efficacy of our algorithms and show that our regret analysis is nearly tight.

Bias-scalable analog computing is attractive for implementing machine learning (ML) processors with distinct power-performance specifications. For example, ML implementations for server workloads are focused on computational throughput and faster training, whereas ML implementations for edge devices are focused on energy-efficient inference. In this paper, we demonstrate the implementation of bias-scalable analog computing circuits using a generalization of the Margin Propagation (MP) principle called shape-based analog computing (S-AC). The resulting S-AC core integrates several near-memory compute elements, which include: (a) non-linear activation functions; (b) inner-product compute circuits; and (c) a mixed-signal compressive memory. Using measured results from prototypes fabricated in a 180nm CMOS process, we demonstrate that the performance of computing modules remains robust to transistor biasing and variations in temperature. In this paper, we also demonstrate bias-scalability for a simple ML regression task.

As a representative evidential clustering algorithm, evidential c-means (ECM) provides a deeper insight into the data by allowing an object to belong not only to a single class, but also to any subset of a collection of classes, which generalizes the hard, fuzzy, possibilistic, and rough partitions. However, compared with other partition-based algorithms, ECM must estimate numerous additional parameters, and thus insufficient or contaminated data will have a greater influence on its clustering performance. To solve this problem, in this study, a transfer learning-based ECM (TECM) algorithm is proposed by introducing the strategy of transfer learning into the process of evidential clustering. The TECM objective function is constructed by integrating the knowledge learned from the source domain with the data in the target domain to cluster the target data. Subsequently, an alternate optimization scheme is developed to solve the constraint objective function of the TECM algorithm. The proposed TECM algorithm is applicable to cases where the source and target domains have the same or different numbers of clusters. A series of experiments were conducted on both synthetic and real datasets, and the experimental results demonstrated the effectiveness of the proposed TECM algorithm compared to ECM and other representative multitask or transfer-clustering algorithms.

The concept of causality plays an important role in human cognition . In the past few decades, causal inference has been well developed in many fields, such as computer science, medicine, economics, and education. With the advancement of deep learning techniques, it has been increasingly used in causal inference against counterfactual data. Typically, deep causal models map the characteristics of covariates to a representation space and then design various objective optimization functions to estimate counterfactual data unbiasedly based on the different optimization methods. This paper focuses on the survey of the deep causal models, and its core contributions are as follows: 1) we provide relevant metrics under multiple treatments and continuous-dose treatment; 2) we incorporate a comprehensive overview of deep causal models from both temporal development and method classification perspectives; 3) we assist a detailed and comprehensive classification and analysis of relevant datasets and source code.

In this paper, we extend the Wiener-Ito chaos decomposition to the class of diffusion processes, whose drift and diffusion coefficient are of linear growth. By omitting the orthogonality in the chaos expansion, we are able to show that every $p$-integrable functional, for $p \in [1,\infty)$, can be represented as sum of iterated integrals of the underlying process. Using a truncated sum of this expansion and (possibly random) neural networks for the integrands, whose parameters are learned in a machine learning setting, we show that every financial derivative can be approximated arbitrarily well in the $L^p$-sense. Moreover, the hedging strategy of the approximating financial derivative can be computed in closed form.

Domain adaptation and covariate shift are big issues in deep learning and they ultimately affect any causal inference algorithms that rely on deep neural networks. Causal effect variational autoencoder (CEVAE) is trained to predict the outcome given observational treatment data and it suffers from the distribution shift at test time. In this paper, we introduce uniform treatment variational autoencoders (UTVAE) that are trained with uniform treatment distribution using importance sampling and show that using uniform treatment over observational treatment distribution leads to better causal inference by mitigating the distribution shift that occurs from training to test time. We also explore the combination of uniform and observational treatment distributions with inference and generative network training objectives to find a better training procedure for inferring treatment effects. Experimentally, we find that the proposed UTVAE yields better absolute average treatment effect error and precision in the estimation of heterogeneous effect error than the CEVAE on synthetic and IHDP datasets.

Crop management, including nitrogen (N) fertilization and irrigation management, has a significant impact on the crop yield, economic profit, and the environment. Although management guidelines exist, it is challenging to find the optimal management practices given a specific planting environment and a crop. Previous work used reinforcement learning (RL) and crop simulators to solve the problem, but the trained policies either have limited performance or are not deployable in the real world. In this paper, we present an intelligent crop management system which optimizes the N fertilization and irrigation simultaneously via RL, imitation learning (IL), and crop simulations using the Decision Support System for Agrotechnology Transfer (DSSAT). We first use deep RL, in particular, deep Q-network, to train management policies that require all state information from the simulator as observations (denoted as full observation). We then invoke IL to train management policies that only need a limited amount of state information that can be readily obtained in the real world (denoted as partial observation) by mimicking the actions of the previously RL-trained policies under full observation. We conduct experiments on a case study using maize in Florida and compare trained policies with a maize management guideline in simulations. Our trained policies under both full and partial observations achieve better outcomes, resulting in a higher profit or a similar profit with a smaller environmental impact. Moreover, the partial-observation management policies are directly deployable in the real world as they use readily available information.

Connected robots play a key role in Industry 4.0, providing automation and higher efficiency for many industrial workflows. Unfortunately, these robots can leak sensitive information regarding these operational workflows to remote adversaries. While there exists mandates for the use of end-to-end encryption for data transmission in such settings, it is entirely possible for passive adversaries to fingerprint and reconstruct entire workflows being carried out -- establishing an understanding of how facilities operate. In this paper, we investigate whether a remote attacker can accurately fingerprint robot movements and ultimately reconstruct operational workflows. Using a neural network approach to traffic analysis, we find that one can predict TLS-encrypted movements with around ~60% accuracy, increasing to near-perfect accuracy under realistic network conditions. Further, we also find that attackers can reconstruct warehousing workflows with similar success. Ultimately, simply adopting best cybersecurity practices is clearly not enough to stop even weak (passive) adversaries.

Asset allocation (or portfolio management) is the task of determining how to optimally allocate funds of a finite budget into a range of financial instruments/assets such as stocks. This study investigated the performance of reinforcement learning (RL) when applied to portfolio management using model-free deep RL agents. We trained several RL agents on real-world stock prices to learn how to perform asset allocation. We compared the performance of these RL agents against some baseline agents. We also compared the RL agents among themselves to understand which classes of agents performed better. From our analysis, RL agents can perform the task of portfolio management since they significantly outperformed two of the baseline agents (random allocation and uniform allocation). Four RL agents (A2C, SAC, PPO, and TRPO) outperformed the best baseline, MPT, overall. This shows the abilities of RL agents to uncover more profitable trading strategies. Furthermore, there were no significant performance differences between value-based and policy-based RL agents. Actor-critic agents performed better than other types of agents. Also, on-policy agents performed better than off-policy agents because they are better at policy evaluation and sample efficiency is not a significant problem in portfolio management. This study shows that RL agents can substantially improve asset allocation since they outperform strong baselines. On-policy, actor-critic RL agents showed the most promise based on our analysis.

Sequence models in reinforcement learning require task knowledge to estimate the task policy. This paper presents a hierarchical algorithm for learning a sequence model from demonstrations. The high-level mechanism guides the low-level controller through the task by selecting sub-goals for the latter to reach. This sequence replaces the returns-to-go of previous methods, improving its performance overall, especially in tasks with longer episodes and scarcer rewards. We validate our method in multiple tasks of OpenAIGym, D4RL and RoboMimic benchmarks. Our method outperforms the baselines in eight out of ten tasks of varied horizons and reward frequencies without prior task knowledge, showing the advantages of the hierarchical model approach for learning from demonstrations using a sequence model.

Data augmentation is a cornerstone of the machine learning pipeline, yet its theoretical underpinnings remain unclear. Is it merely a way to artificially augment the data set size? Or is it about encouraging the model to satisfy certain invariance? In this work we consider another angle, and we study the effect of data augmentation on the dynamic of the learning process. We find that data augmentation can alter the relative importance of various features, effectively making certain informative but hard to learn features more likely to be captured in the learning process. Importantly, we show that this effect is more pronounced for non-linear models, such as neural networks. Our main contribution is a detailed analysis of data augmentation on the learning dynamic for a two layer convolutional neural network in the recently proposed multi-view data model by Allen-Zhu and Li [2020]. We complement this analysis with further experimental evidence that data augmentation can be viewed as feature manipulation.

Partial-label learning (PLL) is a peculiar weakly-supervised learning task where the training samples are generally associated with a set of candidate labels instead of single ground truth. While a variety of label disambiguation methods have been proposed in this domain, they normally assume a class-balanced scenario that may not hold in many real-world applications. Empirically, we observe degenerated performance of the prior methods when facing the combinatorial challenge from the long-tailed distribution and partial-labeling. In this work, we first identify the major reasons that the prior work failed. We subsequently propose SoLar, a novel Optimal Transport-based framework that allows to refine the disambiguated labels towards matching the marginal class prior distribution. SoLar additionally incorporates a new and systematic mechanism for estimating the long-tailed class prior distribution under the PLL setup. Through extensive experiments, SoLar exhibits substantially superior results on standardized benchmarks compared to the previous state-of-the-art PLL methods. Code and data are available at: https://github.com/hbzju/SoLar .

As an emerging type of Neural Networks (NNs), Attention Networks (ATNs) such as Transformers have been shown effective, in terms of accuracy, in many applications. This paper further considers their robustness. More specifically, we are curious about their maximum resilience against local input perturbations compared to the more conventional Multi-Layer Perceptrons (MLPs). Thus, we formulate the verification task into an optimization problem, from which exact robustness values can be obtained. One major challenge, however, is the non-convexity and non-linearity of NNs. While the existing literature has handled the challenge to some extent with methods such as Branch-and-Bound, the additional level of difficulty introduced by the quadratic and exponential functions in the ATNs has not been tackled. Our work reduces this gap by focusing on sparsemax-based ATNs, encoding them into Mixed Integer Quadratically Constrained Programming problems, and proposing two powerful heuristics for a speedup of one order of magnitude. Finally, we train and evaluate several sparsemax-based ATNs and similar-sized ReLU-based MLPs for a lane departure warning task and show that the former is surprisingly less robust despite generally higher accuracy.

Task-oriented communications, mostly using learning-based joint source-channel coding (JSCC), aim to design a communication-efficient edge inference system by transmitting task-relevant information to the receiver. However, only transmitting task-relevant information without introducing any redundancy may cause robustness issues in learning due to the channel variations, and the JSCC which directly maps the source data into continuous channel input symbols poses compatibility issues on existing digital communication systems. In this paper, we address these two issues by first investigating the inherent tradeoff between the informativeness of the encoded representations and the robustness to information distortion in the received representations, and then propose a task-oriented communication scheme with digital modulation, named discrete task-oriented JSCC (DT-JSCC), where the transmitter encodes the features into a discrete representation and transmits it to the receiver with the digital modulation scheme. In the DT-JSCC scheme, we develop a robust encoding framework, named robust information bottleneck (RIB), to improve the communication robustness to the channel variations, and derive a tractable variational upper bound of the RIB objective function using the variational approximation to overcome the computational intractability of mutual information. The experimental results demonstrate that the proposed DT-JSCC achieves better inference performance than the baseline methods with low communication latency, and exhibits robustness to channel variations due to the applied RIB framework.

Optical computing is an emerging technology for next-generation efficient artificial intelligence (AI) due to its ultra-high speed and efficiency. Electromagnetic field simulation is critical to the design, optimization, and validation of photonic devices and circuits. However, costly numerical simulation significantly hinders the scalability and turn-around time in the photonic circuit design loop. Recently, physics-informed neural networks have been proposed to predict the optical field solution of a single instance of a partial differential equation (PDE) with predefined parameters. Their complicated PDE formulation and lack of efficient parametrization mechanisms limit their flexibility and generalization in practical simulation scenarios. In this work, for the first time, a physics-agnostic neural operator-based framework, dubbed NeurOLight, is proposed to learn a family of frequency-domain Maxwell PDEs for ultra-fast parametric photonic device simulation. We balance the efficiency and generalization of NeurOLight via several novel techniques. Specifically, we discretize different devices into a unified domain, represent parametric PDEs with a compact wave prior, and encode the incident light via masked source modeling. We design our model with parameter-efficient cross-shaped NeurOLight blocks and adopt superposition-based augmentation for data-efficient learning. With these synergistic approaches, NeurOLight generalizes to a large space of unseen simulation settings, demonstrates 2-orders-of-magnitude faster simulation speed than numerical solvers, and outperforms prior neural network models by ~54% lower prediction error with ~44% fewer parameters. Our code is available at https://github.com/JeremieMelo/NeurOLight.

Synchronizing decisions across multiple agents in realistic settings is problematic since it requires agents to wait for other agents to terminate and communicate about termination reliably. Ideally, agents should learn and execute asynchronously instead. Such asynchronous methods also allow temporally extended actions that can take different amounts of time based on the situation and action executed. Unfortunately, current policy gradient methods are not applicable in asynchronous settings, as they assume that agents synchronously reason about action selection at every time step. To allow asynchronous learning and decision-making, we formulate a set of asynchronous multi-agent actor-critic methods that allow agents to directly optimize asynchronous policies in three standard training paradigms: decentralized learning, centralized learning, and centralized training for decentralized execution. Empirical results (in simulation and hardware) in a variety of realistic domains demonstrate the superiority of our approaches in large multi-agent problems and validate the effectiveness of our algorithms for learning high-quality and asynchronous solutions.

Deep learning systems have been reported to achieve state-of-the-art performances in many applications, and a key is the existence of well trained classifiers on benchmark datasets. As a main-stream loss function, the cross entropy can easily lead us to find models which demonstrate severe overfitting behavior. In this paper, we show that the existing cross entropy loss minimization problem essentially learns the label conditional entropy (CE) of the underlying data distribution of the dataset. However, the CE learned in this way does not characterize well the information shared by the label and the input. In this paper, we propose a mutual information learning framework where we train deep neural network classifiers via learning the mutual information between the label and the input. Theoretically, we give the population classification error lower bound in terms of the mutual information. In addition, we derive the mutual information lower and upper bounds for a concrete binary classification data model in $\mathbb{R}^n$, and also the error probability lower bound in this scenario. Empirically, we conduct extensive experiments on several benchmark datasets to support our theory. The mutual information learned classifiers (MILCs) achieve far better generalization performances than the conditional entropy learned classifiers (CELCs) with an improvement which can exceed more than 10\% in testing accuracy.

While diffusion models have shown great success in image generation, their noise-inverting generative process does not explicitly consider the structure of images, such as their inherent multi-scale nature. Inspired by diffusion models and the desirability of coarse-to-fine modelling, we propose a new model that generates images through iteratively inverting the heat equation, a PDE that locally erases fine-scale information when run over the 2D plane of the image. We interpret the solution of the forward heat equation as a variational approximation in a diffusion-like latent variable model. We point out emergent qualitative properties not seen in diffusion models, such as disentanglement of overall colour and shape in images and aspects of neural network interpretability. Spectral analysis on natural images elucidates connections to diffusion models and reveals implicit inductive biases in them.

The forecasting of credit default risk has been an active research field for several decades. Historically, logistic regression has been used as a major tool due to its compliance with regulatory requirements: transparency, explainability, and fairness. In recent years, researchers have increasingly used complex and advanced machine learning methods to improve prediction accuracy. Even though a machine learning method could potentially improve the model accuracy, it complicates simple logistic regression, deteriorates explainability, and often violates fairness. In the absence of compliance with regulatory requirements, even highly accurate machine learning methods are unlikely to be accepted by companies for credit scoring. In this paper, we introduce a novel class of monotonic neural additive models, which meet regulatory requirements by simplifying neural network architecture and enforcing monotonicity. By utilizing the special architectural features of the neural additive model, the monotonic neural additive model penalizes monotonicity violations effectively. Consequently, the computational cost of training a monotonic neural additive model is similar to that of training a neural additive model, as a free lunch. We demonstrate through empirical results that our new model is as accurate as black-box fully-connected neural networks, providing a highly accurate and regulated machine learning method.

In neural networks, task-relevant information is represented jointly by groups of neurons. However, the specific way in which the information is distributed among the individual neurons is not well understood: While parts of it may only be obtainable from specific single neurons, other parts are carried redundantly or synergistically by multiple neurons. We show how Partial Information Decomposition (PID), a recent extension of information theory, can disentangle these contributions. From this, we introduce the measure of "Representational Complexity", which quantifies the difficulty of accessing information spread across multiple neurons. We show how this complexity is directly computable for smaller layers. For larger layers, we propose subsampling and coarse-graining procedures and prove corresponding bounds on the latter. Empirically, for quantized deep neural networks solving the MNIST task, we observe that representational complexity decreases both through successive hidden layers and over training. Overall, we propose representational complexity as a principled and interpretable summary statistic for analyzing the structure of neural representations.

Split learning and inference propose to run training/inference of a large model that is split across client devices and the cloud. However, such a model splitting imposes privacy concerns, because the activation flowing through the split layer may leak information about the clients' private input data. There is currently no good way to quantify how much private information is being leaked through the split layer, nor a good way to improve privacy up to the desired level. In this work, we propose to use Fisher information as a privacy metric to measure and control the information leakage. We show that Fisher information can provide an intuitive understanding of how much private information is leaking through the split layer, in the form of an error bound for an unbiased reconstruction attacker. We then propose a privacy-enhancing technique, ReFIL, that can enforce a user-desired level of Fisher information leakage at the split layer to achieve high privacy, while maintaining reasonable utility.

Wireless sensor networks (WSNs) are composed of spatially distributed sensors and are considered vulnerable to attacks by worms and their variants. Due to the distinct strategies of worms propagation, the dynamic behavior varies depending on the different features of the sensors. Modeling the spread of worms can help us understand the worm attack behaviors and analyze the propagation procedure. In this paper, we design a communication model under various worms. We aim to learn our proposed model to analytically derive the dynamics of competitive worms propagation. We develop a new searching space combined with complex neural network models. Furthermore, the experiment results verified our analysis and demonstrated the performance of our proposed learning algorithms.

State-of-the-art object detectors have been shown effective in many applications. Usually, their performance is evaluated based on accuracy metrics such as mean Average Precision. In this paper, we consider a safety property of 3D object detectors in the context of Autonomous Driving (AD). In particular, we propose an essential safety requirement for object detectors in AD and formulate it into a specification. During the formulation, we find that abstracting 3D objects with projected 2D bounding boxes on the image and bird's-eye-view planes allows for a necessary and sufficient condition to the proposed safety requirement. We then leverage the analysis and derive qualitative and quantitative safety metrics based on the Intersection-over-Ground-Truth measure and a distance ratio between predictions and ground truths. Finally, for continual improvement, we formulate safety losses that can be used to optimize object detectors towards higher safety scores. Our experiments with public models on the MMDetection3D library and the nuScenes datasets demonstrate the validity of our consideration and proposals.

Modern machine learning research relies on relatively few carefully curated datasets. Even in these datasets, and typically in `untidy' or raw data, practitioners are faced with significant issues of data quality and diversity which can be prohibitively labor intensive to address. Existing methods for dealing with these challenges tend to make strong assumptions about the particular issues at play, and often require a priori knowledge or metadata such as domain labels. Our work is orthogonal to these methods: we instead focus on providing a unified and efficient framework for Metadata Archaeology -- uncovering and inferring metadata of examples in a dataset. We curate different subsets of data that might exist in a dataset (e.g. mislabeled, atypical, or out-of-distribution examples) using simple transformations, and leverage differences in learning dynamics between these probe suites to infer metadata of interest. Our method is on par with far more sophisticated mitigation methods across different tasks: identifying and correcting mislabeled examples, classifying minority-group samples, prioritizing points relevant for training and enabling scalable human auditing of relevant examples.

Robust controllers ensure stability in feedback loops designed under uncertainty but at the cost of performance. Model uncertainty in time-invariant systems can be reduced by recently proposed learning-based methods, which improve the performance of robust controllers using data. However, in practice, many systems also exhibit uncertainty in the form of changes over time, e.g., due to weight shifts or wear and tear, leading to decreased performance or instability of the learning-based controller. We propose an event-triggered learning algorithm that decides when to learn in the face of uncertainty in the LQR problem with rare or slow changes. Our key idea is to switch between robust and learned controllers. For learning, we first approximate the optimal length of the learning phase via Monte-Carlo estimations using a probabilistic model. We then design a statistical test for uncertain systems based on the moment-generating function of the LQR cost. The test detects changes in the system under control and triggers re-learning when control performance deteriorates due to system changes. We demonstrate improved performance over a robust controller baseline in a numerical example.

In conventional multi-user multiple-input multiple-output (MU-MIMO) systems with frequency division duplexing (FDD), channel acquisition and precoder optimization processes have been designed separately although they are highly coupled. This paper studies an end-to-end design of downlink MU-MIMO systems which include pilot sequences, limited feedback, and precoding. To address this problem, we propose a novel deep learning (DL) framework which jointly optimizes the feedback information generation at users and the precoder design at a base station (BS). Each procedure in the MU-MIMO systems is replaced by intelligently designed multiple deep neural networks (DNN) units. At the BS, a neural network generates pilot sequences and helps the users obtain accurate channel state information. At each user, the channel feedback operation is carried out in a distributed manner by an individual user DNN. Then, another BS DNN collects feedback information from the users and determines the MIMO precoding matrices. A joint training algorithm is proposed to optimize all DNN units in an end-to-end manner. In addition, a training strategy which can avoid retraining for different network sizes for a scalable design is proposed. Numerical results demonstrate the effectiveness of the proposed DL framework compared to classical optimization techniques and other conventional DNN schemes.

Deep learning based image quality assessment (IQA) models usually learn to predict image quality from a single dataset, leading the model to overfit specific scenes. To account for this, mixed datasets training can be an effective way to enhance the generalization capability of the model. However, it is nontrivial to combine different IQA datasets, as their quality evaluation criteria, score ranges, view conditions, as well as subjects are usually not shared during the image quality annotation. In this paper, instead of aligning the annotations, we propose a monotonic neural network for IQA model learning with different datasets combined. In particular, our model consists of a dataset-shared quality regressor and several dataset-specific quality transformers. The quality regressor aims to obtain the perceptual qualities of each dataset while each quality transformer maps the perceptual qualities to the corresponding dataset annotations with their monotonicity maintained. The experimental results verify the effectiveness of the proposed learning strategy and our code is available at https://github.com/fzp0424/MonotonicIQA.

Humans continue to outperform modern AI systems in their ability to parse and understand complex visual scenes flexibly. Attention and memory are two systems known to play a critical role in our ability to selectively maintain and manipulate behaviorally-relevant visual information to solve some of the most challenging visual reasoning tasks. Here, we present a novel architecture for visual reasoning inspired by the cognitive-science literature on visual reasoning, the Memory- and Attention-based (visual) REasOning (MAREO) architecture. MAREO instantiates an active-vision theory, which posits that the brain solves complex visual reasoning problems compositionally by learning to combine previously-learned elementary visual operations to form more complex visual routines. MAREO learns to solve visual reasoning tasks via sequences of attention shifts to route and maintain task-relevant visual information into a memory bank via a multi-head transformer module. Visual routines are then deployed by a dedicated reasoning module trained to judge various relations between objects in the scenes. Experiments on tasks containing complex visual relations (SVRT challenge) and same-different differentiation, relation match to sample, Raven's and Identity rules from ART challenge demonstrate MAREO's ability to learn visual routines in a robust and sample-efficient manner. We also show the zero-shot generalization on unseen tasks and the compositionality nature of the architecture.

In many classification models, data is discretized to better estimate its distribution. Existing discretization methods often target at maximizing the discriminant power of discretized data, while overlooking the fact that the primary target of data discretization in classification is to improve the generalization performance. As a result, the data tend to be over-split into many small bins since the data without discretization retain the maximal discriminant information. Thus, we propose a Max-Dependency-Min-Divergence (MDmD) criterion that maximizes both the discriminant information and generalization ability of the discretized data. More specifically, the Max-Dependency criterion maximizes the statistical dependency between the discretized data and the classification variable while the Min-Divergence criterion explicitly minimizes the JS-divergence between the training data and the validation data for a given discretization scheme. The proposed MDmD criterion is technically appealing, but it is difficult to reliably estimate the high-order joint distributions of attributes and the classification variable. We hence further propose a more practical solution, Max-Relevance-Min-Divergence (MRmD) discretization scheme, where each attribute is discretized separately, by simultaneously maximizing the discriminant information and the generalization ability of the discretized data. The proposed MRmD is compared with the state-of-the-art discretization algorithms under the naive Bayes classification framework on 45 machine-learning benchmark datasets. It significantly outperforms all the compared methods on most of the datasets.

Robust Markov decision processes (MDPs) are used for applications of dynamic optimization in uncertain environments and have been studied extensively. Many of the main properties and algorithms of MDPs, such as value iteration and policy iteration, extend directly to RMDPs. Surprisingly, there is no known analog of the MDP convex optimization formulation for solving RMDPs. This work describes the first convex optimization formulation of RMDPs under the classical sa-rectangularity and s-rectangularity assumptions. We derive a convex formulation with a linear number of variables and constraints but large coefficients in the constraints by using entropic regularization and exponential change of variables. Our formulation can be combined with efficient methods from convex optimization to obtain new algorithms for solving RMDPs with uncertain probabilities. We further simplify the formulation for RMDPs with polyhedral uncertainty sets. Our work opens a new research direction for RMDPs and can serve as a first step toward obtaining a tractable convex formulation of RMDPs.

Multi-agent simulation is commonly used across multiple disciplines, specifically in artificial intelligence in recent years, which creates an environment for downstream machine learning or reinforcement learning tasks. In many practical scenarios, however, only the output series that result from the interactions of simulation agents are observable. Therefore, simulators need to be calibrated so that the simulated output series resemble historical -- which amounts to solving a complex simulation optimization problem. In this paper, we propose a simple and efficient framework for calibrating simulator parameters from historical output series observations. First, we consider a novel concept of eligibility set to bypass the potential non-identifiability issue. Second, we generalize the two-sample Kolmogorov-Smirnov (K-S) test with Bonferroni correction to test the similarity between two high-dimensional distributions, which gives a simple yet effective distance metric between the output series sample sets. Third, we suggest using Bayesian optimization (BO) and trust-region BO (TuRBO) to minimize the aforementioned distance metric. Finally, we demonstrate the efficiency of our framework using numerical experiments both on a multi-agent financial market simulator.

Since demand is influenced by a wide variety of causes, it is necessary to decompose the explana-tory variables into different levels, extract their relationships effectively, and reflect them in the forecast. In particular, this contextual information can be very useful in demand forecasting with large demand volatility or intermittent demand patterns. Convolutional neural networks (CNNs) have been successfully used in many fields where important information in data is represented by images. CNNs are powerful because they accept samples as images and use adjacent voxel sets to integrate multi-dimensional important information and learn important features. On the other hand, although the demand-forecasting model has been improved, the input data is still limited in its tabular form and is not suitable for CNN modeling. In this study, we propose a Tab2vox neural architecture search (NAS) model as a method to convert a high-dimensional tabular sam-ple into a well-formed 3D voxel image and use it in a 3D CNN network. For each image repre-sentation, the 3D CNN forecasting model proposed from the Tab2vox framework showed supe-rior performance, compared to the existing time series and machine learning techniques using tabular data, and the latest image transformation studies.

Federated Learning (FL) seeks to distribute model training across local clients without collecting data in a centralized data-center, hence removing data-privacy concerns. A major challenge for FL is data heterogeneity (where each client's data distribution can differ) as it can lead to weight divergence among local clients and slow global convergence. The current SOTA FL methods designed for data heterogeneity typically impose regularization to limit the impact of non-IID data and are stateful algorithms, i.e., they maintain local statistics over time. While effective, these approaches can only be used for a special case of FL involving only a small number of reliable clients. For the more typical applications of FL where the number of clients is large (e.g., edge-device and mobile applications), these methods cannot be applied, motivating the need for a stateless approach to heterogeneous FL which can be used for any number of clients. We derive a first-order gradient regularization to penalize inconsistent local updates due to local data heterogeneity. Specifically, to mitigate weight divergence, we introduce a first-order approximation of the global data distribution into local objectives, which intuitively penalizes updates in the opposite direction of the global update. The end result is a stateless FL algorithm that achieves 1) significantly faster convergence (i.e., fewer communication rounds) and 2) higher overall converged performance than SOTA methods under non-IID data distribution. Importantly, our approach does not impose unrealistic limits on the client size, enabling learning from a large number of clients as is typical in most FL applications.

We study the problem of extracting biometric information of individuals by looking at shadows of objects cast on diffuse surfaces. We show that the biometric information leakage from shadows can be sufficient for reliable identity inference under representative scenarios via a maximum likelihood analysis. We then develop a learning-based method that demonstrates this phenomenon in real settings, exploiting the subtle cues in the shadows that are the source of the leakage without requiring any labeled real data. In particular, our approach relies on building synthetic scenes composed of 3D face models obtained from a single photograph of each identity. We transfer what we learn from the synthetic data to the real data using domain adaptation in a completely unsupervised way. Our model is able to generalize well to the real domain and is robust to several variations in the scenes. We report high classification accuracies in an identity classification task that takes place in a scene with unknown geometry and occluding objects.

Considering processes of a business in a recommender system is highly advantageous. Although most studies in the business process analysis domain are of descriptive and predictive nature, the feasibility of constructing a process-aware recommender system is assessed in a few works. One reason can be the lack of knowledge on process mining potential for recommendation problems. Therefore, this paper aims to identify and analyze the published studies on process-aware recommender system techniques in business process management and process mining domain. A systematic review was conducted on 33 academic articles published between 2008 and 2020 according to several aspects. In this regard, we provide a state-of-the-art review with critical details and researchers with a better perception of which path to pursue in this field. Moreover, based on a knowledge base and holistic perspective, we discuss some research gaps and open challenges in this field.

We present tntorch, a tensor learning framework that supports multiple decompositions (including Candecomp/Parafac, Tucker, and Tensor Train) under a unified interface. With our library, the user can learn and handle low-rank tensors with automatic differentiation, seamless GPU support, and the convenience of PyTorch's API. Besides decomposition algorithms, tntorch implements differentiable tensor algebra, rank truncation, cross-approximation, batch processing, comprehensive tensor arithmetics, and more.

Accurate and agile trajectory tracking in sub-gram Micro Aerial Vehicles (MAVs) is challenging, as the small scale of the robot induces large model uncertainties, demanding robust feedback controllers, while the fast dynamics and computational constraints prevent the deployment of computationally expensive strategies. In this work, we present an approach for agile and computationally efficient trajectory tracking on the MIT SoftFly, a sub-gram MAV (0.7 grams). Our strategy employs a cascaded control scheme, where an adaptive attitude controller is combined with a neural network policy trained to imitate a trajectory tracking robust tube model predictive controller (RTMPC). The neural network policy is obtained using our recent work, which enables the policy to preserve the robustness of RTMPC, but at a fraction of its computational cost. We experimentally evaluate our approach, achieving position Root Mean Square Errors lower than 1.8 cm even in the more challenging maneuvers, obtaining a 60% reduction in maximum position error compared to our previous work, and demonstrating robustness to large external disturbances

Self-supervised neural language models with attention have recently been applied to biological sequence data, advancing structure, function and mutational effect prediction. Some protein language models, including MSA Transformer and AlphaFold's EvoFormer, take multiple sequence alignments (MSAs) of evolutionarily related proteins as inputs. Simple combinations of MSA Transformer's row attentions have led to state-of-the-art unsupervised structural contact prediction. We demonstrate that similarly simple, and universal, combinations of MSA Transformer's column attentions strongly correlate with Hamming distances between sequences in MSAs. Therefore, MSA-based language models encode detailed phylogenetic relationships. We further show that these models can separate coevolutionary signals encoding functional and structural constraints from phylogenetic correlations reflecting historical contingency. To assess this, we generate synthetic MSAs, either without or with phylogeny, from Potts models trained on natural MSAs. We find that unsupervised contact prediction is substantially more resilient to phylogenetic noise when using MSA Transformer versus inferred Potts models.

Visualizing optimization landscapes has led to many fundamental insights in numeric optimization, and novel improvements to optimization techniques. However, visualizations of the objective that reinforcement learning optimizes (the "reward surface") have only ever been generated for a small number of narrow contexts. This work presents reward surfaces and related visualizations of 27 of the most widely used reinforcement learning environments in Gym for the first time. We also explore reward surfaces in the policy gradient direction and show for the first time that many popular reinforcement learning environments have frequent "cliffs" (sudden large drops in expected return). We demonstrate that A2C often "dives off" these cliffs into low reward regions of the parameter space while PPO avoids them, confirming a popular intuition for PPO's improved performance over previous methods. We additionally introduce a highly extensible library that allows researchers to easily generate these visualizations in the future. Our findings provide new intuition to explain the successes and failures of modern RL methods, and our visualizations concretely characterize several failure modes of reinforcement learning agents in novel ways.

Graph neural networks, a powerful deep learning tool to model graph-structured data, have demonstrated remarkable performance on numerous graph learning tasks. To address the data noise and data scarcity issues in deep graph learning, the research on graph data augmentation has intensified lately. However, conventional data augmentation methods can hardly handle graph-structured data which is defined in non-Euclidean space with multi-modality. In this survey, we formally formulate the problem of graph data augmentation and further review the representative techniques and their applications in different deep graph learning problems. Specifically, we first propose a taxonomy for graph data augmentation techniques and then provide a structured review by categorizing the related work based on the augmented information modalities. Moreover, we summarize the applications of graph data augmentation in two representative problems in data-centric deep graph learning: (1) reliable graph learning which focuses on enhancing the utility of input graph as well as the model capacity via graph data augmentation; and (2) low-resource graph learning which targets on enlarging the labeled training data scale through graph data augmentation. For each problem, we also provide a hierarchical problem taxonomy and review the existing literature related to graph data augmentation. Finally, we point out promising research directions and the challenges in future research.

Deep learning inspired by differential equations is a recent research trend and has marked the state of the art performance for many machine learning tasks. Among them, time-series modeling with neural controlled differential equations (NCDEs) is considered as a breakthrough. In many cases, NCDE-based models not only provide better accuracy than recurrent neural networks (RNNs) but also make it possible to process irregular time-series. In this work, we enhance NCDEs by redesigning their core part, i.e., generating a continuous path from a discrete time-series input. NCDEs typically use interpolation algorithms to convert discrete time-series samples to continuous paths. However, we propose to i) generate another latent continuous path using an encoder-decoder architecture, which corresponds to the interpolation process of NCDEs, i.e., our neural network-based interpolation vs. the existing explicit interpolation, and ii) exploit the generative characteristic of the decoder, i.e., extrapolation beyond the time domain of original data if needed. Therefore, our NCDE design can use both the interpolated and the extrapolated information for downstream machine learning tasks. In our experiments with 5 real-world datasets and 12 baselines, our extrapolation and interpolation-based NCDEs outperform existing baselines by non-trivial margins.

Efforts to promote equitable public policy with algorithms appear to be fundamentally constrained by the "impossibility of fairness" (an incompatibility between mathematical definitions of fairness). This technical limitation raises a central question about algorithmic fairness: How can computer scientists and policymakers support equitable policy reforms with algorithms? In this article, I argue that promoting justice with algorithms requires reforming the methodology of algorithmic fairness. First, I diagnose why the current methodology for algorithmic fairness--which I call "formal algorithmic fairness"--leads to the impossibility of fairness and to models that exacerbate oppression despite appearing "fair." I demonstrate that the problems of algorithmic fairness result from the field's methodology, which restricts analysis to isolated decision-making procedures. Second, I draw on theories of substantive equality from law and philosophy to propose an alternative methodology: "substantive algorithmic fairness." Because substantive algorithmic fairness takes a more expansive scope to fairness, it enables an escape from the impossibility of fairness and provides a rigorous guide for alleviating injustice with algorithms. In sum, substantive algorithmic fairness presents a new direction for algorithmic fairness: away from formal mathematical models of "fair" decision-making and toward substantive evaluations of how algorithms can (and cannot) promote justice.

Neural Networks as fast physics simulators have a large potential for many engineering design tasks. Prerequisites for a wide-spread application are an easy-to-use workflow for generating training datasets in a reasonable time, and the capability of the network to generalize to unseen systems. In contrast to most previous works where training systems are similar to the evaluation dataset, we propose to adapt the type of training system to the network architecture. Specifically, we apply a fully convolutional network and, thus, design 3D systems of randomly located voxels with randomly assigned physical properties. The idea is tested for the transient heat diffusion in electronic systems. Training only on random "Minecraft" systems, we obtain good generalization to electronic systems four times as large as the training systems (one-step prediction error of 0.07% vs 0.8%).

In this work, we demonstrate how a publicly available, pre-trained Jukebox model can be adapted for the problem of audio source separation from a single mixed audio channel. Our neural network architecture, which is using transfer learning, is quick to train and the results demonstrate performance comparable to other state-of-the-art approaches that require a lot more compute resources, training data, and time. We provide an open-source code implementation of our architecture (https://github.com/wzaielamri/unmix)

Vision transformers have shown excellent performance in computer vision tasks. However, the computation cost of their (local) self-attention mechanism is expensive. Comparatively, CNN is more efficient with built-in inductive bias. Recent works show that CNN is promising to compete with vision transformers by learning their architecture design and training protocols. Nevertheless, existing methods either ignore multi-level features or lack dynamic prosperity, leading to sub-optimal performance. In this paper, we propose a novel attention mechanism named MCA, which captures different patterns of input images by multiple kernel sizes and enables input-adaptive weights with a gating mechanism. Based on MCA, we present a neural network named ConvFormer. ConvFormer adopts the general architecture of vision transformers, while replacing the (local) self-attention mechanism with our proposed MCA. Extensive experimental results demonstrated that ConvFormer outperforms similar size vision transformers(ViTs) and convolutional neural networks (CNNs) in various tasks. For example, ConvFormer-S, ConvFormer-L achieve state-of-the-art performance of 82.8%, 83.6% top-1 accuracy on ImageNet dataset. Moreover, ConvFormer-S outperforms Swin-T by 1.5 mIoU on ADE20K, and 0.9 bounding box AP on COCO with a smaller model size. Code and models will be available.

In this paper, we study contrastive learning from an optimization perspective, aiming to analyze and address a fundamental issue of existing contrastive learning methods that either rely on a large batch size or a large dictionary of feature vectors. We consider a global objective for contrastive learning, which contrasts each positive pair with all negative pairs for an anchor point. From the optimization perspective, we explain why existing methods such as SimCLR require a large batch size in order to achieve a satisfactory result. In order to remove such requirement, we propose a memory-efficient Stochastic Optimization algorithm for solving the Global objective of Contrastive Learning of Representations, named SogCLR. We show that its optimization error is negligible under a reasonable condition after a sufficient number of iterations or is diminishing for a slightly different global contrastive objective. Empirically, we demonstrate that SogCLR with small batch size (e.g., 256) can achieve similar performance as SimCLR with large batch size (e.g., 8192) on self-supervised learning task on ImageNet-1K. We also attempt to show that the proposed optimization technique is generic and can be applied to solving other contrastive losses, e.g., two-way contrastive losses for bimodal contrastive learning. The proposed method is implemented in our open-sourced library LibAUC (www.libauc.org).

Data-driven approaches and paradigms have become promising solutions to efficient network performances through optimization. These approaches focus on state-of-the-art machine learning techniques that can address the needs of 5G networks and the networks of tomorrow, such as proactive load balancing. In contrast to model-based approaches, data-driven approaches do not need accurate models to tackle the target problem, and their associated architectures provide a flexibility of available system parameters that improve the feasibility of learning-based algorithms in mobile wireless networks. The work presented in this paper focuses on demonstrating a working system prototype of the 5G Core (5GC) network and the Network Data Analytics Function (NWDAF) used to bring the benefits of data-driven techniques to fruition. Analyses of the network-generated data explore core intra-network interactions through unsupervised learning, clustering, and evaluate these results as insights for future opportunities and works.

Reconstructing spectral functions from Euclidean Green's functions is an important inverse problem in many-body physics. However, the inversion is proved to be ill-posed in the realistic systems with noisy Green's functions. In this Letter, we propose an automatic differentiation(AD) framework as a generic tool for the spectral reconstruction from propagator observable. Exploiting the neural networks' regularization as a non-local smoothness regulator of the spectral function, we represent spectral functions by neural networks and use the propagator's reconstruction error to optimize the network parameters unsupervisedly. In the training process, except for the positive-definite form for the spectral function, there are no other explicit physical priors embedded into the neural networks. The reconstruction performance is assessed through relative entropy and mean square error for two different network representations. Compared to the maximum entropy method, the AD framework achieves better performance in the large-noise situation. It is noted that the freedom of introducing non-local regularization is an inherent advantage of the present framework and may lead to substantial improvements in solving inverse problems.

Predictive models are increasingly used to make various consequential decisions in high-stakes domains such as healthcare, finance, and policy. It becomes critical to ensure that these models make accurate predictions, are robust to shifts in the data, do not rely on spurious features, and do not unduly discriminate against minority groups. To this end, several approaches spanning various areas such as explainability, fairness, and robustness have been proposed in recent literature. Such approaches need to be human-centered as they cater to the understanding of the models to their users. However, there is a research gap in understanding the human-centric needs and challenges of monitoring machine learning (ML) models once they are deployed. To fill this gap, we conducted an interview study with 13 practitioners who have experience at the intersection of deploying ML models and engaging with customers spanning domains such as financial services, healthcare, hiring, online retail, computational advertising, and conversational assistants. We identified various human-centric challenges and requirements for model monitoring in real-world applications. Specifically, we found the need and the challenge for the model monitoring systems to clarify the impact of the monitoring observations on outcomes. Further, such insights must be actionable, robust, customizable for domain-specific use cases, and cognitively considerate to avoid information overload.

Limited availability of labeled-data makes any supervised learning problem challenging. Alternative learning settings like semi-supervised and universum learning alleviate the dependency on labeled data, but still require a large amount of unlabeled data, which may be unavailable or expensive to acquire. GAN-based data generation methods have recently shown promise by generating synthetic samples to improve learning. However, most existing GAN based approaches either provide poor discriminator performance under limited labeled data settings; or results in low quality generated data. In this paper, we propose a Universum GAN game which provides improved discriminator accuracy under limited data settings, while generating high quality realistic data. We further propose an evolving discriminator loss which improves its convergence and generalization performance. We derive the theoretical guarantees and provide empirical results in support of our approach.

Deep learning has led to great progress in the detection of mobile (i.e. movement-capable) objects in urban driving scenes in recent years. Supervised approaches typically require the annotation of large training sets; there has thus been great interest in leveraging weakly, semi- or self-supervised methods to avoid this, with much success. Whilst weakly and semi-supervised methods require some annotation, self-supervised methods have used cues such as motion to relieve the need for annotation altogether. However, a complete absence of annotation typically degrades their performance, and ambiguities that arise during motion grouping can inhibit their ability to find accurate object boundaries. In this paper, we propose a new self-supervised mobile object detection approach called SCT. This uses both motion cues and expected object sizes to improve detection performance, and predicts a dense grid of 3D oriented bounding boxes to improve object discovery. We significantly outperform the state-of-the-art self-supervised mobile object detection method TCR on the KITTI tracking benchmark, and achieve performance that is within 30% of the fully supervised PV-RCNN++ method for IoUs <= 0.5.

In this paper, we propose MENAS, an efficient multi-trial evolution-based NAS method with less human intervention. Specifically, we propose an enlarged search space (MobileNet3-MT) for ImageNet-1K and improve the search efficiency from two aspects. First, MENAS jointly explores architectures and optimal pruned candidates (Lottery Tickets), gradually slimming the average model in populations. Each model is trained with an early stop and replaced by its Lottery Tickets, instead of first searching for a cumbersome network then conducting pruning. Second, we introduce individual weight sharing, which is dedicated to multi-trial NAS, aiming to amortize the training costs by sharing weights between parents and child networks. Compared with weight sharing in supernet, individual weight sharing attains more reliable rank consistency, meanwhile is easy to implement by preventing the sophisticated supernet training. Moreover, to regularize the evolutionary process from trapped in small models, we preserve a small ratio of the largest models when formulating parent populations, which is proved beneficial to enhance model performance. Extensive experiment results demonstrate the superiority of MENAS. On the ImageNet-1K database, MENAS achieves 80.5% top-1 accuracy without involving knowledge distillation or larger image resolution. Code and models will be available.

Seeking informative projecting directions has been an important task in utilizing sliced Wasserstein distance in applications. However, finding these directions usually requires an iterative optimization procedure over the space of projecting directions, which is computationally expensive. Moreover, the computational issue is even more severe in deep learning applications, where computing the distance between two mini-batch probability measures is repeated several times. This nested loop has been one of the main challenges that prevent the usage of sliced Wasserstein distances based on good projections in practice. To address this challenge, we propose to utilize the learning-to-optimize technique or amortized optimization to predict the informative direction of any given two mini-batch probability measures. To the best of our knowledge, this is the first work that bridges amortized optimization and sliced Wasserstein generative models. In particular, we derive linear amortized models, generalized linear amortized models, and non-linear amortized models which are corresponding to three types of novel mini-batch losses, named amortized sliced Wasserstein. We demonstrate the favorable performance of the proposed sliced losses in deep generative modeling on standard benchmark datasets.

Federated Learning (FL) enables distributed training of machine learning models while keeping personal data on user devices private. While we witness increasing applications of FL in the area of mobile sensing, such as human activity recognition (HAR), FL has not been studied in the context of a multi-device environment (MDE), wherein each user owns multiple data-producing devices. With the proliferation of mobile and wearable devices, MDEs are increasingly becoming popular in ubicomp settings, therefore necessitating the study of FL in them. FL in MDEs is characterized by being not independent and identically distributed (non-IID) across clients, complicated by the presence of both user and device heterogeneities. Further, ensuring efficient utilization of system resources on FL clients in a MDE remains an important challenge. In this paper, we propose FLAME, a user-centered FL training approach to counter statistical and system heterogeneity in MDEs, and bring consistency in inference performance across devices. FLAME features (i) user-centered FL training utilizing the time alignment across devices from the same user; (ii) accuracy- and efficiency-aware device selection; and (iii) model personalization to devices. We also present an FL evaluation testbed with realistic energy drain and network bandwidth profiles, and a novel class-based data partitioning scheme to extend existing HAR datasets to a federated setup. Our experiment results on three multi-device HAR datasets show that FLAME outperforms various baselines by 4.3-25.8% higher F1 score, 1.02-2.86x greater energy efficiency, and up to 2.06x speedup in convergence to target accuracy through fair distribution of the FL workload.

Clustered federated learning (FL) has been shown to produce promising results by grouping clients into clusters. This is especially effective in scenarios where separate groups of clients have significant differences in the distributions of their local data. Existing clustered FL algorithms are essentially trying to group together clients with similar distributions so that clients in the same cluster can leverage each other's data to better perform federated learning. However, prior clustered FL algorithms attempt to learn these distribution similarities indirectly during training, which can be quite time consuming as many rounds of federated learning may be required until the formation of clusters is stabilized. In this paper, we propose a new approach to federated learning that directly aims to efficiently identify distribution similarities among clients by analyzing the principal angles between the client data subspaces. Each client applies a truncated singular value decomposition (SVD) step on its local data in a single-shot manner to derive a small set of principal vectors, which provides a signature that succinctly captures the main characteristics of the underlying distribution. This small set of principal vectors is provided to the server so that the server can directly identify distribution similarities among the clients to form clusters. This is achieved by comparing the similarities of the principal angles between the client data subspaces spanned by those principal vectors. The approach provides a simple, yet effective clustered FL framework that addresses a broad range of data heterogeneity issues beyond simpler forms of Non-IIDness like label skews. Our clustered FL approach also enables convergence guarantees for non-convex objectives. Our code is available at https://github.com/MMorafah/PACFL.

The conventional sliced Wasserstein is defined between two probability measures that have realizations as vectors. When comparing two probability measures over images, practitioners first need to vectorize images and then project them to one-dimensional space by using matrix multiplication between the sample matrix and the projection matrix. After that, the sliced Wasserstein is evaluated by averaging the two corresponding one-dimensional projected probability measures. However, this approach has two limitations. The first limitation is that the spatial structure of images is not captured efficiently by the vectorization step; therefore, the later slicing process becomes harder to gather the discrepancy information. The second limitation is memory inefficiency since each slicing direction is a vector that has the same dimension as the images. To address these limitations, we propose novel slicing methods for sliced Wasserstein between probability measures over images that are based on the convolution operators. We derive convolution sliced Wasserstein (CSW) and its variants via incorporating stride, dilation, and non-linear activation function into the convolution operators. We investigate the metricity of CSW as well as its sample complexity, its computational complexity, and its connection to conventional sliced Wasserstein distances. Finally, we demonstrate the favorable performance of CSW over the conventional sliced Wasserstein in comparing probability measures over images and in training deep generative modeling on images.

Dynamic treatment regimes (DTRs) are personalized, adaptive, multi-stage treatment plans that adapt treatment decisions both to an individual's initial features and to intermediate outcomes and features at each subsequent stage, which are affected by decisions in prior stages. Examples include personalized first- and second-line treatments of chronic conditions like diabetes, cancer, and depression, which adapt to patient response to first-line treatment, disease progression, and individual characteristics. While existing literature mostly focuses on estimating the optimal DTR from offline data such as from sequentially randomized trials, we study the problem of developing the optimal DTR in an online manner, where the interaction with each individual affect both our cumulative reward and our data collection for future learning. We term this the DTR bandit problem. We propose a novel algorithm that, by carefully balancing exploration and exploitation, is guaranteed to achieve rate-optimal regret when the transition and reward models are linear. We demonstrate our algorithm and its benefits both in synthetic experiments and in a case study of adaptive treatment of major depressive disorder using real-world data.

Learning representations from electrocardiogram (ECG) signals can serve as a fundamental step for different machine learning-based ECG tasks. In order to extract general ECG representations that can be adapted to various downstream tasks, the learning process needs to be based on a general ECG-related task which can be achieved through self-supervised learning (SSL). However, existing SSL approaches either fail to provide satisfactory ECG representations or require too much effort to construct the learning data. In this paper, we propose the T-S reverse detection, a simple yet effective self-supervised approach to learn ECG representations. Inspired by the temporal and spatial characteristics of ECG signals, we flip the original signals horizontally (temporal reverse), vertically (spatial reverse), and both horizontally and vertically (temporal-spatial reverse). Learning is then done by classifying four types of signals including the original one. To verify the effectiveness of the proposed method, we perform a downstream task to detect atrial fibrillation (AF) which is one of the most common ECG tasks. The results show that the ECG representations learned with our method achieve remarkable performance. Furthermore, after exploring the representation feature space and investigating salient ECG locations, we conclude that the temporal reverse is more effective for learning ECG representations than the spatial reverse.

Classification tasks are usually evaluated in terms of accuracy. However, accuracy is discontinuous and cannot be directly optimized using gradient ascent. Popular methods minimize cross-entropy, hinge loss, or other surrogate losses, which can lead to suboptimal results. In this paper, we propose a new optimization framework by introducing stochasticity to a model's output and optimizing expected accuracy, i.e. accuracy of the stochastic model. Extensive experiments on linear models and deep image classification show that the proposed optimization method is a powerful alternative to widely used classification losses.

Software vulnerabilities (SVs) have become a common, serious and crucial concern due to the ubiquity of computer software. Many machine learning-based approaches have been proposed to solve the software vulnerability detection (SVD) problem. However, there are still two open and significant issues for SVD in terms of i) learning automatic representations to improve the predictive performance of SVD, and ii) tackling the scarcity of labeled vulnerabilities datasets that conventionally need laborious labeling effort by experts. In this paper, we propose a novel end-to-end approach to tackle these two crucial issues. We first exploit the automatic representation learning with deep domain adaptation for software vulnerability detection. We then propose a novel cross-domain kernel classifier leveraging the max-margin principle to significantly improve the transfer learning process of software vulnerabilities from labeled projects into unlabeled ones. The experimental results on real-world software datasets show the superiority of our proposed method over state-of-the-art baselines. In short, our method obtains a higher performance on F1-measure, the most important measure in SVD, from 1.83% to 6.25% compared to the second highest method in the used datasets. Our released source code samples are publicly available at https://github.com/vannguyennd/dam2p

We consider the closely related problems of sampling from a distribution known up to a normalizing constant, and estimating said normalizing constant. We show how variational autoencoders (VAEs) can be applied to this task. In their standard applications, VAEs are trained to fit data drawn from an intractable distribution. We invert the logic and train the VAE to fit a simple and tractable distribution, on the assumption of a complex and intractable latent distribution, specified up to normalization. This procedure constructs approximations without the use of training data or Markov chain Monte Carlo sampling. We illustrate our method on three examples: the Ising model, graph clustering, and ranking.

Despite a surge of recent advances in promoting machine Learning (ML) fairness, the existing mainstream approaches mostly require training or finetuning the entire weights of the neural network to meet the fairness criteria. However, this is often infeasible in practice for those large-scale trained models due to large computational and storage costs, low data efficiency, and model privacy issues. In this paper, we propose a new generic fairness learning paradigm, called FairReprogram, which incorporates the model reprogramming technique. Specifically, FairReprogram considers the neural model fixed, and instead appends to the input a set of perturbations, called the fairness trigger, which is tuned towards the fairness criteria under a min-max formulation. We further introduce an information-theoretic framework that explains why and under what conditions fairness goals can be achieved using the fairness trigger. We show both theoretically and empirically that the fairness trigger can effectively obscure demographic biases in the output prediction of fixed ML models by providing false demographic information that hinders the model from utilizing the correct demographic information to make the prediction. Extensive experiments on both NLP and CV datasets demonstrate that our method can achieve better fairness improvements than retraining-based methods with far less training cost and data dependency under two widely-used fairness criteria.

With the rising participation of the common mass in social media, it is increasingly common now for policymakers/journalists to create online polls on social media to understand the political leanings of people in specific locations. The caveat here is that only influential people can make such an online polling and reach out at a mass scale. Further, in such cases, the distribution of voters is not controllable and may be, in fact, biased. On the other hand,if we can interpret the publicly available data over social media to probe the political inclination of users, we will be able to have controllable insights about the survey population, keep the cost of survey low and also collect publicly available data without involving the concerned persons. Hence we introduce a self-attentive semi-supervised framework for political inclination detection to further that objective. The advantage of our model is that it neither needs huge training data nor does it need to store social network parameters. Nevertheless, it achieves an accuracy of 93.7\% with no annotated data; further, with only a few annotated examples per class it achieves competitive performance. We found that the model is highly efficient even in resource-constrained settings, and insights drawn from its predictions match the manual survey outcomes when applied to diverse real-life scenarios.

LCRL is a software tool that implements model-free Reinforcement Learning (RL) algorithms over unknown Markov Decision Processes (MDPs), synthesising policies that satisfy a given linear temporal specification with maximal probability. LCRL leverages partially deterministic finite-state machines known as Limit Deterministic Buchi Automata (LDBA) to express a given linear temporal specification. A reward function for the RL algorithm is shaped on-the-fly, based on the structure of the LDBA. Theoretical guarantees under proper assumptions ensure the convergence of the RL algorithm to an optimal policy that maximises the satisfaction probability. We present case studies to demonstrate the applicability, ease of use, scalability, and performance of LCRL. Owing to the LDBA-guided exploration and LCRL model-free architecture, we observe robust performance, which also scales well when compared to standard RL approaches (whenever applicable to LTL specifications). Full instructions on how to execute all the case studies in this paper are provided on a GitHub page that accompanies the LCRL distribution www.github.com/grockious/lcrl.

The process of obtaining high-resolution images from single or multiple low-resolution images of the same scene is of great interest for real-world image and signal processing applications. This study is about exploring the potential usage of deep learning based image super-resolution algorithms on thermal data for producing high quality thermal imaging results for in-cabin vehicular driver monitoring systems. In this work we have proposed and developed a novel multi-image super-resolution recurrent neural network to enhance the resolution and improve the quality of low-resolution thermal imaging data captured from uncooled thermal cameras. The end-to-end fully convolutional neural network is trained from scratch on newly acquired thermal data of 30 different subjects in indoor environmental conditions. The effectiveness of the thermally tuned super-resolution network is validated quantitatively as well as qualitatively on test data of 6 distinct subjects. The network was able to achieve a mean peak signal to noise ratio of 39.24 on the validation dataset for 4x super-resolution, outperforming bicubic interpolation both quantitatively and qualitatively.

During recent years transformers architectures have been growing in popularity. Modulated Detection Transformer (MDETR) is an end-to-end multi-modal understanding model that performs tasks such as phase grounding, referring expression comprehension, referring expression segmentation, and visual question answering. One remarkable aspect of the model is the capacity to infer over classes that it was not previously trained for. In this work we explore the use of MDETR in a new task, action detection, without any previous training. We obtain quantitative results using the Atomic Visual Actions dataset. Although the model does not report the best performance in the task, we believe that it is an interesting finding. We show that it is possible to use a multi-modal model to tackle a task that it was not designed for. Finally, we believe that this line of research may lead into the generalization of MDETR in additional downstream tasks.

Current abstractive summarization models either suffer from a lack of clear interpretability or provide incomplete rationales by only highlighting parts of the source document. To this end, we propose the Summarization Program (SP), an interpretable modular framework consisting of an (ordered) list of binary trees, each encoding the step-by-step generative process of an abstractive summary sentence from the source document. A Summarization Program contains one root node per summary sentence, and a distinct tree connects each summary sentence (root node) to the document sentences (leaf nodes) from which it is derived, with the connecting nodes containing intermediate generated sentences. Edges represent different modular operations involved in summarization such as sentence fusion, compression, and paraphrasing. We first propose an efficient best-first search method over neural modules, SP-Search that identifies SPs for human summaries by directly optimizing for ROUGE scores. Next, using these programs as automatic supervision, we propose seq2seq models that generate Summarization Programs, which are then executed to obtain final summaries. We demonstrate that SP-Search effectively represents the generative process behind human summaries using modules that are typically faithful to their intended behavior. We also conduct a simulation study to show that Summarization Programs improve the interpretability of summarization models by allowing humans to better simulate model reasoning. Summarization Programs constitute a promising step toward interpretable and modular abstractive summarization, a complex task previously addressed primarily through blackbox end-to-end neural systems. Our code is available at https://github.com/swarnaHub/SummarizationPrograms

Traditional causal inference approaches leverage observational study data to estimate the difference in observed and unobserved outcomes for a potential treatment, known as the Conditional Average Treatment Effect (CATE). However, CATE corresponds to the comparison on the first moment alone, and as such may be insufficient in reflecting the full picture of treatment effects. As an alternative, estimating the full potential outcome distributions could provide greater insights. However, existing methods for estimating treatment effect potential outcome distributions often impose restrictive or simplistic assumptions about these distributions. Here, we propose Collaborating Causal Networks (CCN), a novel methodology which goes beyond the estimation of CATE alone by learning the full potential outcome distributions. Estimation of outcome distributions via the CCN framework does not require restrictive assumptions of the underlying data generating process. Additionally, CCN facilitates estimation of the utility of each possible treatment and permits individual-specific variation through utility functions. CCN not only extends outcome estimation beyond traditional risk difference, but also enables a more comprehensive decision-making process through definition of flexible comparisons. Under assumptions commonly made in the causal literature, we show that CCN learns distributions that asymptotically capture the true potential outcome distributions. Furthermore, we propose an adjustment approach that is empirically effective in alleviating sample imbalance between treatment groups in observational data. Finally, we evaluate the performance of CCN in multiple synthetic and semi-synthetic experiments. We demonstrate that CCN learns improved distribution estimates compared to existing Bayesian and deep generative methods as well as improved decisions with respects to a variety of utility functions.

As one of the most successful AI-powered applications, recommender systems aim to help people make appropriate decisions in an effective and efficient way, by providing personalized suggestions in many aspects of our lives, especially for various human-oriented online services such as e-commerce platforms and social media sites. In the past few decades, the rapid developments of recommender systems have significantly benefited human by creating economic value, saving time and effort, and promoting social good. However, recent studies have found that data-driven recommender systems can pose serious threats to users and society, such as spreading fake news to manipulate public opinion in social media sites, amplifying unfairness toward under-represented groups or individuals in job matching services, or inferring privacy information from recommendation results. Therefore, systems' trustworthiness has been attracting increasing attention from various aspects for mitigating negative impacts caused by recommender systems, so as to enhance the public's trust towards recommender systems techniques. In this survey, we provide a comprehensive overview of Trustworthy Recommender systems (TRec) with a specific focus on six of the most important aspects; namely, Safety & Robustness, Nondiscrimination & Fairness, Explainability, Privacy, Environmental Well-being, and Accountability & Auditability. For each aspect, we summarize the recent related technologies and discuss potential research directions to help achieve trustworthy recommender systems in the future.

Music contains hierarchical structures beyond beats and measures. While hierarchical structure annotations are helpful for music information retrieval and computer musicology, such annotations are scarce in current digital music databases. In this paper, we explore a data-driven approach to automatically extract hierarchical metrical structures from scores. We propose a new model with a Temporal Convolutional Network-Conditional Random Field (TCN-CRF) architecture. Given a symbolic music score, our model takes in an arbitrary number of voices in a beat-quantized form, and predicts a 4-level hierarchical metrical structure from downbeat-level to section-level. We also annotate a dataset using RWC-POP MIDI files to facilitate training and evaluation. We show by experiments that the proposed method performs better than the rule-based approach under different orchestration settings. We also perform some simple musicological analysis on the model predictions. All demos, datasets and pre-trained models are publicly available on Github.

We present the Grasp Proposal Network (GP-net), a Convolutional Neural Network model which can generate 6-DOF grasps for mobile manipulators. To train GP-net, we synthetically generate a dataset containing depth-images and ground-truth grasp information for more than 1400 objects. In real-world experiments we use the EGAD! grasping benchmark to evaluate GP-net against two commonly used algorithms, the Volumetric Grasping Network (VGN) and the Grasp Pose Detection package (GPD), on a PAL TIAGo mobile manipulator. GP-net achieves grasp success rates of 82.2% compared to 57.8% for VGN and 63.3% with GPD. In contrast to the state-of-the-art methods in robotic grasping, GP-net can be used out-of-the-box for grasping objects with mobile manipulators without limiting the workspace, requiring table segmentation or needing a high-end GPU. To encourage the usage of GP-net, we provide a ROS package along with our code and pre-trained models at https://aucoroboticsmu.github.io/GP-net/.

Connected teleoperated robotic systems play a key role in ensuring operational workflows are carried out with high levels of accuracy and low margins of error. In recent years, a variety of attacks have been proposed that actively target the robot itself from the cyber domain. However, little attention has been paid to the capabilities of a passive attacker. In this work, we investigate whether an insider adversary can accurately fingerprint robot movements and operational warehousing workflows via the radio frequency side channel in a stealthy manner. Using an SVM for classification, we found that an adversary can fingerprint individual robot movements with at least 96% accuracy, increasing to near perfect accuracy when reconstructing entire warehousing workflows.

Hate speech detection is a common downstream application of natural language processing (NLP) in the real world. In spite of the increasing accuracy, current data-driven approaches could easily learn biases from the imbalanced data distributions originating from humans. The deployment of biased models could further enhance the existing social biases. But unlike handling tabular data, defining and mitigating biases in text classifiers, which deal with unstructured data, are more challenging. A popular solution for improving machine learning fairness in NLP is to conduct the debiasing process with a list of potentially discriminated words given by human annotators. In addition to suffering from the risks of overlooking the biased terms, exhaustively identifying bias with human annotators are unsustainable since discrimination is variable among different datasets and may evolve over time. To this end, we propose an automatic misuse detector (MiD) relying on an explanation method for detecting potential bias. And built upon that, an end-to-end debiasing framework with the proposed staged correction is designed for text classifiers without any external resources required.

This paper considers improving wireless communication and computation efficiency in federated learning (FL) via model quantization. In the proposed bitwidth FL scheme, edge devices train and transmit quantized versions of their local FL model parameters to a coordinating server, which, in turn, aggregates them into a quantized global model and synchronizes the devices. The goal is to jointly determine the bitwidths employed for local FL model quantization and the set of devices participating in FL training at each iteration. This problem is posed as an optimization problem whose goal is to minimize the training loss of quantized FL under a per-iteration device sampling budget and delay requirement. To derive the solution, an analytical characterization is performed in order to show how the limited wireless resources and induced quantization errors affect the performance of the proposed FL method. The analytical results show that the improvement of FL training loss between two consecutive iterations depends on the device selection and quantization scheme as well as on several parameters inherent to the model being learned. Given linear regression-based estimates of these model properties, it is shown that the FL training process can be described as a Markov decision process (MDP), and, then, a model-based reinforcement learning (RL) method is proposed to optimize action selection over iterations. Compared to model-free RL, this model-based RL approach leverages the derived mathematical characterization of the FL training process to discover an effective device selection and quantization scheme without imposing additional device communication overhead. Simulation results show that the proposed FL algorithm can reduce 29% and 63% convergence time compared to a model free RL method and the standard FL method, respectively.

Overparameterized deep networks are known to be able to perfectly fit the training data while at the same time showing good generalization performance. A common paradigm drawn from intuition on linear regression suggests that large networks are able to interpolate even noisy data, without considerably deviating from the ground-truth signal. At present, a precise characterization of this phenomenon is missing. In this work, we present an empirical study of sharpness of the loss landscape of deep networks as we systematically control the number of model parameters and training epochs. We extend our study to neighbourhoods of the training data, as well as around cleanly- and noisily-labelled samples. Our findings show that the loss sharpness in the input space follows both model- and epoch-wise double descent, with worse peaks observed around noisy labels. While small interpolating models sharply fit both clean and noisy data, large models express a smooth and flat loss landscape, in contrast with existing intuition.

Accuracy and Diversity are two essential metrizable manifestations in generating natural and semantically correct captions. Many efforts have been made to enhance one of them with another decayed due to the trade-off gap. In this work, we will show that the inferior standard of accuracy draws from human annotations (leave-one-out) are not appropriate for machine-generated captions. To improve diversity with a solid accuracy performance, we exploited a novel Variational Transformer framework. By introducing the "Invisible Information Prior" and the "Auto-selectable GMM", we instruct the encoder to learn the precise language information and object relation in different scenes for accuracy assurance. By introducing the "Range-Median Reward" baseline, we retain more diverse candidates with higher rewards during the RL-based training process for diversity assurance. Experiments show that our method achieves the simultaneous promotion of accuracy (CIDEr) and diversity (self-CIDEr), up to 1.1 and 4.8 percent. Also, our method got the most similar performance of the semantic retrieval compared to human annotations, with 50.3 (50.6 of human) for R@1(i2t).

Anomaly detection describes methods of finding abnormal states, instances or data points that differ from a normal value space. Industrial processes are a domain where predicitve models are needed for finding anomalous data instances for quality enhancement. A main challenge, however, is absence of labels in this environment. This paper contributes to a data-centric way of approaching artificial intelligence in industrial production. With a use case from additive manufacturing for automotive components we present a deep-learning-based image processing pipeline. We integrate the concept of domain randomisation and synthetic data in the loop that shows promising results for bridging advances in deep learning and its application to real-world, industrial production processes.

Regret has been widely adopted as the metric of choice for evaluating the performance of online optimization algorithms for distributed, multi-agent systems. However, data/model variations associated with agents can significantly impact decisions and requires consensus among agents. Moreover, most existing works have focused on developing approaches for (either strongly or non-strongly) convex losses, and very few results have been obtained regarding regret bounds in distributed online optimization for general non-convex losses. To address these two issues, we propose a novel composite regret with a new network regret-based metric to evaluate distributed online optimization algorithms. We concretely define static and dynamic forms of the composite regret. By leveraging the dynamic form of our composite regret, we develop a consensus-based online normalized gradient (CONGD) approach for pseudo-convex losses, and it provably shows a sublinear behavior relating to a regularity term for the path variation of the optimizer. For general non-convex losses, we first shed light on the regret for the setting of distributed online non-convex learning based on recent advances such that no deterministic algorithm can achieve the sublinear regret. We then develop the distributed online non-convex optimization with composite regret (DINOCO) without access to the gradients, depending on an offline optimization oracle. DINOCO is shown to achieve sublinear regret; to our knowledge, this is the first regret bound for general distributed online non-convex learning.

Set-valued classification, a new classification paradigm that aims to identify all the plausible classes that an observation belongs to, can be obtained by learning the acceptance regions for all classes. Many existing set-valued classification methods do not consider the possibility that a new class that never appeared in the training data appears in the test data. Moreover, they are computationally expensive when the number of classes is large. We propose a Generalized Prediction Set (GPS) approach to estimate the acceptance regions while considering the possibility of a new class in the test data. The proposed classifier minimizes the expected size of the prediction set while guaranteeing that the class-specific accuracy is at least a pre-specified value. Unlike previous methods, the proposed method achieves a good balance between accuracy, efficiency, and anomaly detection rate. Moreover, our method can be applied in parallel to all the classes to alleviate the computational burden. Both theoretical analysis and numerical experiments are conducted to illustrate the effectiveness of the proposed method.

Software vulnerabilities existing in a program or function of computer systems are a serious and crucial concern. Typically, in a program or function consisting of hundreds or thousands of source code statements, there are only few statements causing the corresponding vulnerabilities. Vulnerability labeling is currently done on a function or program level by experts with the assistance of machine learning tools. Extending this approach to the code statement level is much more costly and time-consuming and remains an open problem. In this paper we propose a novel end-to-end deep learning-based approach to identify the vulnerability-relevant code statements of a specific function. Inspired by the specific structures observed in real world vulnerable code, we first leverage mutual information for learning a set of latent variables representing the relevance of the source code statements to the corresponding function's vulnerability. We then propose novel clustered spatial contrastive learning in order to further improve the representation learning and the robust selection process of vulnerability-relevant code statements. Experimental results on real-world datasets of 200k+ C/C++ functions show the superiority of our method over other state-of-the-art baselines. In general, our method obtains a higher performance in VCP, VCA, and Top-10 ACC measures of between 3\% to 14\% over the baselines when running on real-world datasets in an unsupervised setting. Our released source code samples are publicly available at \href{https://github.com/vannguyennd/livuitcl}{https://github.com/vannguyennd/livuitcl.}

Nowadays, more and more datasets are published towards research and development of systems and models, enabling direct comparisons, continuous improvement of solutions, and researchers engagement with experimental, real life data. However, especially in the Structural Health Monitoring (SHM) domain, there are plenty of cases where new research projects have a unique combination of structure design and implementation, sensor selection and technological enablers that does not fit with the configuration of relevant individual studies in the literature. Thus, we share the data from our case study to the research community as we did not find any relevant repository available. More specifically, in this paper, we present a novel time-series dataset for impact detection and localization on a plastic thin-plate, towards Structural Health Monitoring applications, using ceramic piezoelectric transducers (PZTs) connected to an Internet of Things (IoT) device. The dataset was collected from an experimental procedure of low-velocity, low-energy impact events that includes at least 3 repetitions for each unique experiment, while the input measurements come from 4 PZT sensors placed at the corners of the plate. For each repetition and sensor, 5000 values are stored with 100 KHz sampling rate. The system is excited with a steel ball, and the height from which it is released varies from 10 cm to 20 cm. The dataset is available in GitHub (https://github.com/Smart-Objects/Impact-Events-Dataset).

Network architecture search (NAS), in particular the differentiable architecture search (DARTS) method, has shown a great power to learn excellent model architectures on the specific dataset of interest. In contrast to using a fixed dataset, in this work, we focus on a different but important scenario for NAS: how to refine a deployed network's model architecture to enhance its robustness with the guidance of a few collected and misclassified examples that are degraded by some real-world unknown corruptions having a specific pattern (e.g., noise, blur, etc.). To this end, we first conduct an empirical study to validate that the model architectures can be definitely related to the corruption patterns. Surprisingly, by just adding a few corrupted and misclassified examples (e.g., $10^3$ examples) to the clean training dataset (e.g., $5.0 \times 10^4$ examples), we can refine the model architecture and enhance the robustness significantly. To make it more practical, the key problem, i.e., how to select the proper failure examples for the effective NAS guidance, should be carefully investigated. Then, we propose a novel core-failure-set guided DARTS that embeds a K-center-greedy algorithm for DARTS to select suitable corrupted failure examples to refine the model architecture. We use our method for DARTS-refined DNNs on the clean as well as 15 corruptions with the guidance of four specific real-world corruptions. Compared with the state-of-the-art NAS as well as data-augmentation-based enhancement methods, our final method can achieve higher accuracy on both corrupted datasets and the original clean dataset. On some of the corruption patterns, we can achieve as high as over 45% absolute accuracy improvements.

We study the problem of off-policy evaluation (OPE) for episodic Partially Observable Markov Decision Processes (POMDPs) with continuous states. Motivated by the recently proposed proximal causal inference framework, we develop a non-parametric identification result for estimating the policy value via a sequence of so-called V-bridge functions with the help of time-dependent proxy variables. We then develop a fitted-Q-evaluation-type algorithm to estimate V-bridge functions recursively, where a non-parametric instrumental variable (NPIV) problem is solved at each step. By analyzing this challenging sequential NPIV problem, we establish the finite-sample error bounds for estimating the V-bridge functions and accordingly that for evaluating the policy value, in terms of the sample size, length of horizon and so-called (local) measure of ill-posedness at each step. To the best of our knowledge, this is the first finite-sample error bound for OPE in POMDPs under non-parametric models.

Multi-agent reinforcement learning (MARL) has emerged as a useful approach to solving decentralised decision-making problems at scale. Research in the field has been growing steadily with many breakthrough algorithms proposed in recent years. In this work, we take a closer look at this rapid development with a focus on evaluation methodologies employed across a large body of research in cooperative MARL. By conducting a detailed meta-analysis of prior work, spanning 75 papers accepted for publication from 2016 to 2022, we bring to light worrying trends that put into question the true rate of progress. We further consider these trends in a wider context and take inspiration from single-agent RL literature on similar issues with recommendations that remain applicable to MARL. Combining these recommendations, with novel insights from our analysis, we propose a standardised performance evaluation protocol for cooperative MARL. We argue that such a standard protocol, if widely adopted, would greatly improve the validity and credibility of future research, make replication and reproducibility easier, as well as improve the ability of the field to accurately gauge the rate of progress over time by being able to make sound comparisons across different works. Finally, we release our meta-analysis data publicly on our project website for future research on evaluation: https://sites.google.com/view/marl-standard-protocol

Given a portrait image of a person and an environment map of the target lighting, portrait relighting aims to re-illuminate the person in the image as if the person appeared in an environment with the target lighting. To achieve high-quality results, recent methods rely on deep learning. An effective approach is to supervise the training of deep neural networks with a high-fidelity dataset of desired input-output pairs, captured with a light stage. However, acquiring such data requires an expensive special capture rig and time-consuming efforts, limiting access to only a few resourceful laboratories. To address the limitation, we propose a new approach that can perform on par with the state-of-the-art (SOTA) relighting methods without requiring a light stage. Our approach is based on the realization that a successful relighting of a portrait image depends on two conditions. First, the method needs to mimic the behaviors of physically-based relighting. Second, the output has to be photorealistic. To meet the first condition, we propose to train the relighting network with training data generated by a virtual light stage that performs physically-based rendering on various 3D synthetic humans under different environment maps. To meet the second condition, we develop a novel synthetic-to-real approach to bring photorealism to the relighting network output. In addition to achieving SOTA results, our approach offers several advantages over the prior methods, including controllable glares on glasses and more temporally-consistent results for relighting videos.

Data-driven models for nonlinear dynamical systems based on approximating the underlying Koopman operator or generator have proven to be successful tools for forecasting, feature learning, state estimation, and control. It has become well known that the Koopman generators for control-affine systems also have affine dependence on the input, leading to convenient finite-dimensional bilinear approximations of the dynamics. Yet there are still two main obstacles that limit the scope of current approaches for approximating the Koopman generators of systems with actuation. First, the performance of existing methods depends heavily on the choice of basis functions over which the Koopman generator is to be approximated; and there is currently no universal way to choose them for systems that are not measure preserving. Secondly, if we do not observe the full state, we may not gain access to a sufficiently rich collection of such functions to describe the dynamics. This is because the commonly used method of forming time-delayed observables fails when there is actuation. To remedy these issues, we write the dynamics of observables governed by the Koopman generator as a bilinear hidden Markov model, and determine the model parameters using the expectation-maximization (EM) algorithm. The E-step involves a standard Kalman filter and smoother, while the M-step resembles control-affine dynamic mode decomposition for the generator. We demonstrate the performance of this method on three examples, including recovery of a finite-dimensional Koopman-invariant subspace for an actuated system with a slow manifold; estimation of Koopman eigenfunctions for the unforced Duffing equation; and model-predictive control of a fluidic pinball system based only on noisy observations of lift and drag.

Text-to-text transformers have shown remarkable success in the task of multi-task transfer learning, especially in natural language processing (NLP). However, while there have been several attempts to train transformers on different domains, there is usually a clear relationship between these domains, e.g.,, code summarization, where the natural language summary describes the code. There have been very few attempts to study how multi-task transfer learning works on tasks in significantly different domains. In this project, we investigated the behavior of multi-domain, multi-task learning using multi-domain text-to-text transfer transformers (MD-T5) on four tasks across two domains - Python Code and Chess. We carried out extensive experiments using three popular training strategies: Bert-style joint pretraining + successive finetuning, GPT-style joint pretraining + successive finetuning, and GPT-style joint pretraining + joint finetuning. Also, we evaluate the model on four metrics - Play Score, Eval Score, BLEU Score, and Multi-Domain Learning Score (MDLS). These metrics measure performance across the various tasks and multi-domain learning. We show that while negative knowledge transfer and catastrophic forgetting are still considerable challenges for all the models, the GPT-style joint pretraining + joint finetuning strategy showed the most promise in multi-domain, multi-task learning as it performs well across all four tasks while still keeping its multi-domain knowledge.

Crop residue burning is a major source of air pollution in many parts of the world, notably South Asia. Policymakers, practitioners and researchers have invested in both measuring impacts and developing interventions to reduce burning. However, measuring the impacts of burning or the effectiveness of interventions to reduce burning requires data on where burning occurred. These data are challenging to collect in the field, both in terms of cost and feasibility. We take advantage of data from ground-based monitoring of crop residue burning in Punjab, India to explore whether burning can be detected more effectively using accessible satellite imagery. Specifically, we used 3m PlanetScope data with high temporal resolution (up to daily) as well as publicly-available Sentinel-2 data with weekly temporal resolution but greater depth of spectral information. Following an analysis of the ability of different spectral bands and burn indices to separate burned and unburned plots individually, we built a Random Forest model with those determined to provide the greatest separability and evaluated model performance with ground-verified data. Our overall model accuracy of 82-percent is favorable given the challenges presented by the measurement. Based on insights from this process, we discuss technical challenges of detecting crop residue burning from satellite imagery as well as challenges to measuring impacts, both of burning and of policy interventions.

Considering two decision-making tasks $A$ and $B$, each of which wishes to compute an effective \textit{decision} $Y$ for a given \textit{query} $X$, {can we solve task $B$ by using query-decision pairs $(X, Y)$ of $A$ without knowing the latent decision-making model?} Such problems, called \textit{inverse decision-making with task migrations}, are of interest in that the complex and stochastic nature of real-world applications often prevents the agent from completely knowing the underlying system. In this paper, we introduce such a new problem with formal formulations and present a generic framework for addressing decision-making tasks in social contagion management. On the theory side, we present a generalization analysis for justifying the learning performance of our framework. In empirical studies, we perform a sanity check and compare the presented method with other possible learning-based and graph-based methods. We have acquired promising experimental results, confirming for the first time that it is possible to solve one decision-making task by using the solutions associated with another one.

Performing neural network inference on encrypted data without decryption is one popular method to enable privacy-preserving neural networks (PNet) as a service. Compared with regular neural networks deployed for machine-learning-as-a-service, PNet requires additional encoding, e.g., quantized-precision numbers, and polynomial activation. Encrypted input also introduces novel challenges such as adversarial robustness and security. To the best of our knowledge, we are the first to study questions including (i) Whether PNet is more robust against adversarial inputs than regular neural networks? (ii) How to design a robust PNet given the encrypted input without decryption? We propose PNet-Attack to generate black-box adversarial examples that can successfully attack PNet in both target and untarget manners. The attack results show that PNet robustness against adversarial inputs needs to be improved. This is not a trivial task because the PNet model owner does not have access to the plaintext of the input values, which prevents the application of existing detection and defense methods such as input tuning, model normalization, and adversarial training. To tackle this challenge, we propose a new fast and accurate noise insertion method, called RPNet, to design Robust and Private Neural Networks. Our comprehensive experiments show that PNet-Attack reduces at least $2.5\times$ queries than prior works. We theoretically analyze our RPNet methods and demonstrate that RPNet can decrease $\sim 91.88\%$ attack success rate.

For many years, machine learning methods have been used in a wide range of fields, including computer vision and natural language processing. While machine learning methods have significantly improved model performance over traditional methods, their black-box structure makes it difficult for researchers to interpret results. For highly regulated financial industries, transparency, explainability, and fairness are equally, if not more, important than accuracy. Without meeting regulated requirements, even highly accurate machine learning methods are unlikely to be accepted. We address this issue by introducing a novel class of transparent and interpretable machine learning algorithms known as generalized gloves of neural additive models. The generalized gloves of neural additive models separate features into three categories: linear features, individual nonlinear features, and interacted nonlinear features. Additionally, interactions in the last category are only local. The linear and nonlinear components are distinguished by a stepwise selection algorithm, and interacted groups are carefully verified by applying additive separation criteria. Empirical results demonstrate that generalized gloves of neural additive models provide optimal accuracy with the simplest architecture, allowing for a highly accurate, transparent, and explainable approach to machine learning.

In this paper, we describe the top-scoring submissions for team RTZR VoxCeleb Speaker Recognition Challenge 2022 (VoxSRC-22) in the closed dataset, speaker verification Track 1. The top performed system is a fusion of 7 models, which contains 3 different types of model architectures. We focus on training models to learn extra-temporal information. Therefore, all models were trained with 4-6 second frames for each utterance. Also, we apply the Large Margin Fine-tuning strategy which has shown good performance on the previous challenges for some of our fusion models. While the evaluation process, we apply the scoring methods with adaptive symmetric normalization (AS-Norm) and matrix score average (MSA). Finally, we mix up models with logistic regression to fuse all the trained models. The final submission achieves 0.165 DCF and 2.912% EER on the VoxSRC22 test set.

This paper studies stochastic optimization for a sum of compositional functions, where the inner-level function of each summand is coupled with the corresponding summation index. We refer to this family of problems as finite-sum coupled compositional optimization (FCCO). It has broad applications in machine learning for optimizing non-convex or convex compositional measures/objectives such as average precision (AP), p-norm push, listwise ranking losses, neighborhood component analysis (NCA), deep survival analysis, deep latent variable models, etc., which deserves finer analysis. Yet, existing algorithms and analyses are restricted in one or other aspects. The contribution of this paper is to provide a comprehensive convergence analysis of a simple stochastic algorithm for both non-convex and convex objectives. Our key result is the improved oracle complexity with the parallel speed-up by using the moving-average based estimator with mini-batching. Our theoretical analysis also exhibits new insights for improving the practical implementation by sampling the batches of equal size for the outer and inner levels. Numerical experiments on AP maximization, NCA, and p-norm push corroborate some aspects of the theory.

As a relatively new form of sport, esports offers unparalleled data availability. Despite the vast amounts of data that are generated by game engines, it can be challenging to extract them and verify their integrity for the purposes of practical and scientific use. Our work aims to open esports to a broader scientific community by supplying raw and pre-processed files from StarCraft II esports tournaments. These files can be used in statistical and machine learning modeling tasks and related to various laboratory-based measurements (e.g., behavioral tests, brain imaging). We have gathered publicly available game-engine generated "replays" of tournament matches and performed data extraction and cleanup using a low-level application programming interface (API) parser library. Additionally, we open-sourced and published all the custom tools that were developed in the process of creating our dataset. These tools include PyTorch and PyTorch Lightning API abstractions to load and model the data. Our dataset contains replays from major and premiere StarCraft II tournaments since 2016. To prepare the dataset, we processed 55 tournament "replaypacks" that contained 17930 files with game-state information. Based on initial investigation of available StarCraft II datasets, we observed that our dataset is the largest publicly available source of StarCraft II esports data upon its publication. Analysis of the extracted data holds promise for further Artificial Intelligence (AI), Machine Learning (ML), psychological, Human-Computer Interaction (HCI), and sports-related studies in a variety of supervised and self-supervised tasks.

We summarize the model and results of PirouNet, a semi-supervised recurrent variational autoencoder. Given a small amount of dance sequences labeled with qualitative choreographic annotations, PirouNet conditionally generates dance sequences in the style of the choreographer.

Leak detection in gas pipelines is an important and persistent problem in the Oil and Gas industry. This is particularly important as pipelines are the most common way of transporting natural gas. This research aims to study the ability of data-driven intelligent models to detect small leaks for a natural gas pipeline using basic operational parameters and then compare the intelligent models among themselves using existing performance metrics. This project applies the observer design technique to detect leaks in natural gas pipelines using a regressoclassification hierarchical model where an intelligent model acts as a regressor and a modified logistic regression model acts as a classifier. Five intelligent models (gradient boosting, decision trees, random forest, support vector machine and artificial neural network) are studied in this project using a pipeline data stream of four weeks. The results shows that while support vector machine and artificial neural networks are better regressors than the others, they do not provide the best results in leak detection due to their internal complexities and the volume of data used. The random forest and decision tree models are the most sensitive as they can detect a leak of 0.1% of nominal flow in about 2 hours. All the intelligent models had high reliability with zero false alarm rate in testing phase. The average time to leak detection for all the intelligent models was compared to a real time transient model in literature. The results show that intelligent models perform relatively well in the problem of leak detection. This result suggests that intelligent models could be used alongside a real time transient model to significantly improve leak detection results.

We address the lack of reliability in benchmarking clustering techniques based on labeled datasets. A standard scheme in external clustering validation is to use class labels as ground truth clusters, based on the assumption that each class forms a single, clearly separated cluster. However, as such cluster-label matching (CLM) assumption often breaks, the lack of conducting a sanity check for the CLM of benchmark datasets casts doubt on the validity of external validations. Still, evaluating the degree of CLM is challenging. For example, internal clustering validation measures can be used to quantify CLM within the same dataset to evaluate its different clusterings but are not designed to compare clusterings of different datasets. In this work, we propose a principled way to generate between-dataset internal measures that enable the comparison of CLM across datasets. We first determine four axioms for between-dataset internal measures, complementing Ackerman and Ben-David's within-dataset axioms. We then propose processes to generalize internal measures to fulfill these new axioms, and use them to extend the widely used Calinski-Harabasz index for between-dataset CLM evaluation. Through quantitative experiments, we (1) verify the validity and necessity of the generalization processes and (2) show that the proposed between-dataset Calinski-Harabasz index accurately evaluates CLM across datasets. Finally, we demonstrate the importance of evaluating CLM of benchmark datasets before conducting external validation.

We study the oracle complexity of producing $(\delta,\epsilon)$-stationary points of Lipschitz functions, in the sense proposed by Zhang et al. [2020]. While there exist dimension-free randomized algorithms for producing such points within $\widetilde{O}(1/\delta\epsilon^3)$ first-order oracle calls, we show that no dimension-free rate can be achieved by a deterministic algorithm. On the other hand, we point out that this rate can be derandomized for smooth functions with merely a logarithmic dependence on the smoothness parameter. Moreover, we establish several lower bounds for this task which hold for any randomized algorithm, with or without convexity. Finally, we show how the convergence rate of finding $(\delta,\epsilon)$-stationary points can be improved in case the function is convex, a setting which we motivate by proving that in general no finite time algorithm can produce points with small subgradients even for convex functions.

Generalized Complete Intersection Calabi-Yau Manifold (gCICY) is a new construction of Calabi-Yau manifolds established recently. However, the generation of new gCICYs using standard algebraic method is very laborious. Due to this complexity, the number of gCICYs and their classification still remain unknown. In this paper, we try to make some progress in this direction using neural network. The results showed that our trained models can have a high precision on the existing type $(1,1)$ and type $(2,1)$ gCICYs in the literature. Moreover, They can achieve a $97\%$ precision in predicting new gCICY which is generated differently from those used for training and testing. This shows that machine learning could be an effective method to classify and generate new gCICY.

In this paper, we present an acoustic side channel attack which makes use of smartphone microphones recording a robot in operation to exploit acoustic properties of the sound to fingerprint a robot's movements. In this work we consider the possibility of an insider adversary who is within physical proximity of a robotic system (such as a technician or robot operator), equipped with only their smartphone microphone. Through the acoustic side-channel, we demonstrate that it is indeed possible to fingerprint not only individual robot movements within 3D space, but also patterns of movements which could lead to inferring the purpose of the movements (i.e. surgical procedures which a surgical robot is undertaking) and hence, resulting in potential privacy violations. Upon evaluation, we find that individual robot movements can be fingerprinted with around 75% accuracy, decreasing slightly with more fine-grained movement meta-data such as distance and speed. Furthermore, workflows could be reconstructed with around 62% accuracy as a whole, with more complex movements such as pick-and-place or packing reconstructed with near perfect accuracy. As well as this, in some environments such as surgical settings, audio may be recorded and transmitted over VoIP, such as for education/teaching purposes or in remote telemedicine. The question here is, can the same attack be successful even when VoIP communication is employed, and how does packet loss impact the captured audio and the success of the attack? Using the same characteristics of acoustic sound for plain audio captured by the smartphone, the attack was 90% accurate in fingerprinting VoIP samples on average, 15% higher than the baseline without the VoIP codec employed. This opens up new research questions regarding anonymous communications to protect robotic systems from acoustic side channel attacks via VoIP communication networks.

Modern meta-reinforcement learning (Meta-RL) methods are mainly developed based on model-agnostic meta-learning, which performs policy gradient steps across tasks to maximize policy performance. However, the gradient conflict problem is still poorly understood in Meta-RL, which may lead to performance degradation when encountering distinct tasks. To tackle this challenge, this paper proposes a novel personalized Meta-RL (pMeta-RL) algorithm, which aggregates task-specific personalized policies to update a meta-policy used for all tasks, while maintaining personalized policies to maximize the average return of each task under the constraint of the meta-policy. We also provide the theoretical analysis under the tabular setting, which demonstrates the convergence of our pMeta-RL algorithm. Moreover, we extend the proposed pMeta-RL algorithm to a deep network version based on soft actor-critic, making it suitable for continuous control tasks. Experiment results show that the proposed algorithms outperform other previous Meta-RL algorithms on Gym and MuJoCo suites.

We study the adaption of soft actor-critic (SAC)from continuous action space to discrete action space. We revisit vanilla SAC and provide an in-depth understanding of its Q value underestimation and performance instability issues when applied to discrete settings. We thereby propose entropy-penalty and double average Q-learning with Q-clip to address these issues. Extensive experiments on typical benchmarks with discrete action space, including Atari games and a large-scale MOBA game, show the efficacy of our proposed method. Our code is at:https://github.com/coldsummerday/Revisiting-Discrete-SAC.

We propose methods that enable efficient hierarchical classification in parallel. Our methods transform a batch of classification scores and labels, corresponding to given nodes in a semantic tree, to scores and labels corresponding to all nodes in the ancestral paths going down the tree to every given node, relying only on tensor operations that execute efficiently on hardware accelerators. We implement our methods and test them on current hardware accelerators with a tree incorporating all English-language synsets in WordNet 3.0, spanning 117,659 classes in 20 levels of depth. We transform batches of scores and labels to their respective ancestral paths, incurring negligible computation and consuming only a fixed 0.04GB of memory over the footprint of data.

In this paper, we demonstrate and investigate several challenges that stand in the way of tackling complex problems using physics-informed neural networks. In particular, we visualize the loss landscapes of trained models and perform sensitivity analysis of backpropagated gradients in the presence of physics. Our findings suggest that existing methods produce highly non-convex loss landscapes that are difficult to navigate. Furthermore, high-order PDEs contaminate the backpropagated gradients that may impede or prevent convergence. We then propose a novel method that bypasses the calculation of high-order PDE operators and mitigates the contamination of backpropagating gradients. In doing so, we reduce the dimension of the search space of our solution and facilitate learning problems with non-smooth solutions. Our formulation also provides a feedback mechanism that helps our model adaptively focus on complex regions of the domain that are difficult to learn. We then formulate an unconstrained dual problem by adapting the Lagrange multiplier method. We apply our method to solve several challenging benchmark problems governed by linear and non-linear PDEs.

In this paper, we propose projected gradient descent (PGD) algorithms for signal estimation from noisy nonlinear measurements. We assume that the unknown $p$-dimensional signal lies near the range of an $L$-Lipschitz continuous generative model with bounded $k$-dimensional inputs. In particular, we consider two cases when the nonlinear link function is either unknown or known. For unknown nonlinearity, similarly to \cite{liu2020generalized}, we make the assumption of sub-Gaussian observations and propose a linear least-squares estimator. We show that when there is no representation error and the sensing vectors are Gaussian, roughly $O(k \log L)$ samples suffice to ensure that a PGD algorithm converges linearly to a point achieving the optimal statistical rate using arbitrary initialization. For known nonlinearity, we assume monotonicity as in \cite{yang2016sparse}, and make much weaker assumptions on the sensing vectors and allow for representation error. We propose a nonlinear least-squares estimator that is guaranteed to enjoy an optimal statistical rate. A corresponding PGD algorithm is provided and is shown to also converge linearly to the estimator using arbitrary initialization. In addition, we present experimental results on image datasets to demonstrate the performance of our PGD algorithms.

Online social networks are actively involved in the removal of malicious social bots due to their role in the spread of low quality information. However, most of the existing bot detectors are supervised classifiers incapable of capturing the evolving behavior of sophisticated bots. Here we propose MulBot, an unsupervised bot detector based on multivariate time series (MTS). For the first time, we exploit multidimensional temporal features extracted from user timelines. We manage the multidimensionality with an LSTM autoencoder, which projects the MTS in a suitable latent space. Then, we perform a clustering step on this encoded representation to identify dense groups of very similar users -- a known sign of automation. Finally, we perform a binary classification task achieving f1-score $= 0.99$, outperforming state-of-the-art methods (f1-score $\le 0.97$). Not only does MulBot achieve excellent results in the binary classification task, but we also demonstrate its strengths in a novel and practically-relevant task: detecting and separating different botnets. In this multi-class classification task we achieve f1-score $= 0.96$. We conclude by estimating the importance of the different features used in our model and by evaluating MulBot's capability to generalize to new unseen bots, thus proposing a solution to the generalization deficiencies of supervised bot detectors.

Graph anomaly detection (GAD) is a vital task since even a few anomalies can pose huge threats to benign users. Recent semi-supervised GAD methods, which can effectively leverage the available labels as prior knowledge, have achieved superior performances than unsupervised methods. In practice, people usually need to identify anomalies on new (sub)graphs to secure their business, but they may lack labels to train an effective detection model. One natural idea is to directly adopt a trained GAD model to the new (sub)graph for testing. However, we find that existing semi-supervised GAD methods suffer from poor generalization issue, i.e., well-trained models could not perform well on an unseen area (i.e., not accessible in training) of the same graph. It may cause great troubles. In this paper, we base on the phenomenon and propose a general and novel research problem of generalized graph anomaly detection that aims to effectively identify anomalies on both the training-domain graph and unseen testing graph to eliminate potential dangers. Nevertheless, it is a challenging task since only limited labels are available, and the normal background may differ between training and testing data. Accordingly, we propose a data augmentation method named \textit{AugAN} (\uline{Aug}mentation for \uline{A}nomaly and \uline{N}ormal distributions) to enrich training data and boost the generalizability of GAD models. Experiments verify the effectiveness of our method in improving model generalizability.

A key factor to optimal acceptance and comfort of automated vehicle features is the driving style. Mismatches between the automated and the driver preferred driving styles can make users take over more frequently or even disable the automation features. This work proposes identification of user driving style preference with multimodal signals, so the vehicle could match user preference in a continuous and automatic way. We conducted a driving simulator study with 36 participants and collected extensive multimodal data including behavioral, physiological, and situational data. This includes eye gaze, steering grip force, driving maneuvers, brake and throttle pedal inputs as well as foot distance from pedals, pupil diameter, galvanic skin response, heart rate, and situational drive context. Then, we built machine learning models to identify preferred driving styles, and confirmed that all modalities are important for the identification of user preference. This work paves the road for implicit adaptive driving styles on automated vehicles.

Automatic SQL generation has been an active research area, aiming at streamlining the access to databases by writing natural language with the given intent instead of writing SQL. Current SOTA methods for semantic parsing depend on LLMs to achieve high predictive accuracy on benchmark datasets. This reduces their applicability, since LLMs requires expensive GPUs. Furthermore, SOTA methods are ungrounded and thus not guaranteed to always generate valid SQL. Here we propose T5QL, a new SQL generation method that improves the performance in benchmark datasets when using smaller LMs, namely T5-Base, by 13pp when compared against SOTA methods. Additionally, T5QL is guaranteed to always output valid SQL using a context-free grammar to constrain SQL generation. Finally, we show that dividing semantic parsing in two tasks, candidate SQLs generation and candidate re-ranking, is a promising research avenue that can reduce the need for large LMs.

Addressing such diverse ends as safety alignment with human preferences, and the efficiency of learning, a growing line of reinforcement learning research focuses on risk functionals that depend on the entire distribution of returns. Recent work on \emph{off-policy risk assessment} (OPRA) for contextual bandits introduced consistent estimators for the target policy's CDF of returns along with finite sample guarantees that extend to (and hold simultaneously over) all risk. In this paper, we lift OPRA to Markov decision processes (MDPs), where importance sampling (IS) CDF estimators suffer high variance on longer trajectories due to small effective sample size. To mitigate these problems, we incorporate model-based estimation to develop the first doubly robust (DR) estimator for the CDF of returns in MDPs. This estimator enjoys significantly less variance and, when the model is well specified, achieves the Cramer-Rao variance lower bound. Moreover, for many risk functionals, the downstream estimates enjoy both lower bias and lower variance. Additionally, we derive the first minimax lower bounds for off-policy CDF and risk estimation, which match our error bounds up to a constant factor. Finally, we demonstrate the precision of our DR CDF estimates experimentally on several different environments.

The technology of dynamic map fusion among networked vehicles has been developed to enlarge sensing ranges and improve sensing accuracies for individual vehicles. This paper proposes a federated learning (FL) based dynamic map fusion framework to achieve high map quality despite unknown numbers of objects in fields of view (FoVs), various sensing and model uncertainties, and missing data labels for online learning. The novelty of this work is threefold: (1) developing a three-stage fusion scheme to predict the number of objects effectively and to fuse multiple local maps with fidelity scores; (2) developing an FL algorithm which fine-tunes feature models (i.e., representation learning networks for feature extraction) distributively by aggregating model parameters; (3) developing a knowledge distillation method to generate FL training labels when data labels are unavailable. The proposed framework is implemented in the Car Learning to Act (CARLA) simulation platform. Extensive experimental results are provided to verify the superior performance and robustness of the developed map fusion and FL schemes.

The massive use of artificial neural networks (ANNs), increasingly popular in many areas of scientific computing, rapidly increases the energy consumption of modern high-performance computing systems. An appealing and possibly more sustainable alternative is provided by novel neuromorphic paradigms, which directly implement ANNs in hardware. However, little is known about the actual benefits of running ANNs on neuromorphic hardware for use cases in scientific computing. Here we present a methodology for measuring the energy cost and compute time for inference tasks with ANNs on conventional hardware. In addition, we have designed an architecture for these tasks and estimate the same metrics based on a state-of-the-art analog in-memory computing (AIMC) platform, one of the key paradigms in neuromorphic computing. Both methodologies are compared for a use case in quantum many-body physics in two dimensional condensed matter systems and for anomaly detection at 40 MHz rates at the Large Hadron Collider in particle physics. We find that AIMC can achieve up to one order of magnitude shorter computation times than conventional hardware, at an energy cost that is up to three orders of magnitude smaller. This suggests great potential for faster and more sustainable scientific computing with neuromorphic hardware.

Purpose. Handwriting is one of the most frequently occurring patterns in everyday life and with it come challenging applications such as handwriting recognition (HWR), writer identification, and signature verification. In contrast to offline HWR that only uses spatial information (i.e., images), online HWR (OnHWR) uses richer spatio-temporal information (i.e., trajectory data or inertial data). While there exist many offline HWR datasets, there is only little data available for the development of OnHWR methods on paper as it requires hardware-integrated pens. Methods. This paper presents data and benchmark models for real-time sequence-to-sequence (seq2seq) learning and single character-based recognition. Our data is recorded by a sensor-enhanced ballpoint pen, yielding sensor data streams from triaxial accelerometers, a gyroscope, a magnetometer and a force sensor at 100 Hz. We propose a variety of datasets including equations and words for both the writer-dependent and writer-independent tasks. Our datasets allow a comparison between classical OnHWR on tablets and on paper with sensor-enhanced pens. We provide an evaluation benchmark for seq2seq and single character-based HWR using recurrent and temporal convolutional networks and Transformers combined with a connectionist temporal classification (CTC) loss and cross-entropy (CE) losses. Results. Our convolutional network combined with BiLSTMs outperforms Transformer-based architectures, is on par with InceptionTime for sequence-based classification tasks, and yields better results compared to 28 state-of-the-art techniques. Time-series augmentation methods improve the sequence-based task, and we show that CE variants can improve the single classification task.

Recently, Vision Transformer (ViT) has continuously established new milestones in the computer vision field, while the high computation and memory cost makes its propagation in industrial production difficult. Pruning, a traditional model compression paradigm for hardware efficiency, has been widely applied in various DNN structures. Nevertheless, it stays ambiguous on how to perform exclusive pruning on the ViT structure. Considering three key points: the structural characteristics, the internal data pattern of ViTs, and the related edge device deployment, we leverage the input token sparsity and propose a computation-aware soft pruning framework, which can be set up on vanilla Transformers of both flatten and CNN-type structures, such as Pooling-based ViT (PiT). More concretely, we design a dynamic attention-based multi-head token selector, which is a lightweight module for adaptive instance-wise token selection. We further introduce a soft pruning technique, which integrates the less informative tokens generated by the selector module into a package token that will participate in subsequent calculations rather than being completely discarded. Our framework is bound to the trade-off between accuracy and computation constraints of specific edge devices through our proposed computation-aware training strategy. Experimental results show that our framework significantly reduces the computation cost of ViTs while maintaining comparable performance on image classification. Moreover, our framework can guarantee the identified model to meet resource specifications of mobile devices and FPGA, and even achieve the real-time execution of DeiT-T on mobile platforms. For example, our method reduces the latency of DeiT-T to 26 ms (26%$\sim $41% superior to existing works) on the mobile device with 0.25%$\sim $4% higher top-1 accuracy on ImageNet.

We apply the technique of implicit differentiation to boost performance, reduce numerical error, and remove required user-tuning in the Marginal Unbiased Score Expansion (MUSE) algorithm for hierarchical Bayesian inference. We demonstrate these improvements on three representative inference problems: 1) an extended Neal's funnel 2) Bayesian neural networks, and 3) probabilistic principal component analysis. On our particular test cases, MUSE with implicit differentiation is faster than Hamiltonian Monte Carlo by factors of 155, 397, and 5, respectively, or factors of 65, 278, and 1 without implicit differentiation, and yields good approximate marginal posteriors. The Julia and Python MUSE packages have been updated to use implicit differentiation, and can solve problems defined by hand or with any of a number of popular probabilistic programming languages and automatic differentiation backends.

Probabilistic models such as Gaussian processes (GPs) are powerful tools to learn unknown dynamical systems from data for subsequent use in control design. While learning-based control has the potential to yield superior performance in demanding applications, robustness to uncertainty remains an important challenge. Since Bayesian methods quantify uncertainty of the learning results, it is natural to incorporate these uncertainties into a robust design. In contrast to most state-of-the-art approaches that consider worst-case estimates, we leverage the learning method's posterior distribution in the controller synthesis. The result is a more informed and, thus, more efficient trade-off between performance and robustness. We present a novel controller synthesis for linearized GP dynamics that yields robust controllers with respect to a probabilistic stability margin. The formulation is based on a recently proposed algorithm for linear quadratic control synthesis, which we extend by giving probabilistic robustness guarantees in the form of credibility bounds for the system's stability.Comparisons to existing methods based on worst-case and certainty-equivalence designs reveal superior performance and robustness properties of the proposed method.

Reconfigurable intelligent surface (RIS) is an emerging technology for future wireless communication systems. In this work, we consider downlink spatial multiplexing enabled by the RIS for weighted sum-rate (WSR) maximization. In the literature, most solutions use alternating gradient-based optimization, which has moderate performance, high complexity, and limited scalability. We propose to apply a fully convolutional network (FCN) to solve this problem, which was originally designed for semantic segmentation of images. The rectangular shape of the RIS and the spatial correlation of channels with adjacent RIS antennas due to the short distance between them encourage us to apply it for the RIS configuration. We design a set of channel features that includes both cascaded channels via the RIS and the direct channel. In the base station (BS), the differentiable minimum mean squared error (MMSE) precoder is used for pretraining and the weighted minimum mean squared error (WMMSE) precoder is then applied for fine-tuning, which is nondifferentiable, more complex, but achieves a better performance. Evaluation results show that the proposed solution has higher performance and allows for a faster evaluation than the baselines. Hence it scales better to a large number of antennas, advancing the RIS one step closer to practical deployment.

We study the problem of best arm identification in linear bandits in the fixed-budget setting. By leveraging properties of the G-optimal design and incorporating it into the arm allocation rule, we design a parameter-free algorithm, Optimal Design-based Linear Best Arm Identification (OD-LinBAI). We provide a theoretical analysis of the failure probability of OD-LinBAI. Instead of all the optimality gaps, the performance of OD-LinBAI depends only on the gaps of the top $d$ arms, where $d$ is the effective dimension of the linear bandit instance. Complementarily, we present a minimax lower bound for this problem. The upper and lower bounds show that OD-LinBAI is minimax optimal up to constant multiplicative factors in the exponent, which is a significant theoretical improvement over existing methods (e.g., BayesGap, Peace, LinearExploration and GSE), and settles the question of ascertaining the difficulty of learning the best arm in the fixed-budget setting. Finally, numerical experiments demonstrate considerable empirical improvements over existing algorithms on a variety of real and synthetic datasets.

Due to recent climate changes, we have seen more frequent and severe wildfires in the United States. Predicting wildfires is critical for natural disaster prevention and mitigation. Advances in technologies in data processing and communication enabled us to access remote sensing data. With the remote sensing data, valuable spatiotemporal statistical models can be created and used for resource management practices. This paper proposes a distributed learning framework that shares local data collected in ten locations in the western USA throughout the local agents. The local agents aim to predict wildfire grid maps one, two, three, and four weeks in advance while online processing the remote sensing data stream. The proposed model has distinct features that address the characteristic need in prediction evaluations, including dynamic online estimation and time-series modeling. Local fire event triggers are not isolated between locations, and there are confounding factors when local data is analyzed due to incomplete state observations. Compared to existing approaches that do not account for incomplete state observation within wildfire time-series data, on average, we can achieve higher prediction performance.

We introduce the unbounded depth neural network (UDN), an infinitely deep probabilistic model that adapts its complexity to the training data. The UDN contains an infinite sequence of hidden layers and places an unbounded prior on a truncation L, the layer from which it produces its data. Given a dataset of observations, the posterior UDN provides a conditional distribution of both the parameters of the infinite neural network and its truncation. We develop a novel variational inference algorithm to approximate this posterior, optimizing a distribution of the neural network weights and of the truncation depth L, and without any upper limit on L. To this end, the variational family has a special structure: it models neural network weights of arbitrary depth, and it dynamically creates or removes free variational parameters as its distribution of the truncation is optimized. (Unlike heuristic approaches to model search, it is solely through gradient-based optimization that this algorithm explores the space of truncations.) We study the UDN on real and synthetic data. We find that the UDN adapts its posterior depth to the dataset complexity; it outperforms standard neural networks of similar computational complexity; and it outperforms other approaches to infinite-depth neural networks.

Critical scenario generation requires the ability of finding critical parameter combinations from the infinite parameter space in the logic scenario. Existing solutions aims to explore the correlation of parameters in the initial scenario without considering the connection between the parameters in the action sequence. How to model action sequences and consider the effects of different action parameter in the scenario remains a key challenge to solve the problem. In this paper, we propose a framework to generate critical scenarios for speeding up evaluating specific tasks. Specifically, we first propose a description language, BTScenario, to model the scenario, which contains the map, actors, interactions between actors, and oracles. We then use reinforcement learning to search for combinations of critical parameters. By adopting the action mask, the effects of non-fixed length and sequences in parameter space can be prevented. We demonstrate that the proposed framework is more efficient than random test and combination test methods in various scenarios.

Volume data is found in many important scientific and engineering applications. Rendering this data for visualization at high quality and interactive rates for demanding applications such as virtual reality is still not easily achievable even using professional-grade hardware. We introduce FoVolNet -- a method to significantly increase the performance of volume data visualization. We develop a cost-effective foveated rendering pipeline that sparsely samples a volume around a focal point and reconstructs the full-frame using a deep neural network. Foveated rendering is a technique that prioritizes rendering computations around the user's focal point. This approach leverages properties of the human visual system, thereby saving computational resources when rendering data in the periphery of the user's field of vision. Our reconstruction network combines direct and kernel prediction methods to produce fast, stable, and perceptually convincing output. With a slim design and the use of quantization, our method outperforms state-of-the-art neural reconstruction techniques in both end-to-end frame times and visual quality. We conduct extensive evaluations of the system's rendering performance, inference speed, and perceptual properties, and we provide comparisons to competing neural image reconstruction techniques. Our test results show that FoVolNet consistently achieves significant time saving over conventional rendering while preserving perceptual quality.

In recommendation systems, items are likely to be exposed to various users and we would like to learn about the familiarity of a new user with an existing item. This can be formulated as an anomaly detection (AD) problem distinguishing between "common users" (nominal) and "fresh users" (anomalous). Considering the sheer volume of items and the sparsity of user-item paired data, independently applying conventional single-task detection methods on each item quickly becomes difficult, while correlations between items are ignored. To address this multi-task anomaly detection problem, we propose collaborative anomaly detection (CAD) to jointly learn all tasks with an embedding encoding correlations among tasks. We explore CAD with conditional density estimation and conditional likelihood ratio estimation. We found that: $i$) estimating a likelihood ratio enjoys more efficient learning and yields better results than density estimation. $ii$) It is beneficial to select a small number of tasks in advance to learn a task embedding model, and then use it to warm-start all task embeddings. Consequently, these embeddings can capture correlations between tasks and generalize to new correlated tasks.

Latent representations of drugs and their targets produced by contemporary graph autoencoder-based models have proved useful in predicting many types of node-pair interactions on large networks, including drug-drug, drug-target, and target-target interactions. However, most existing approaches model the node's latent spaces in which node distributions are rigid and disjoint; these limitations hinder the methods from generating new links among pairs of nodes. In this paper, we present the effectiveness of variational graph autoencoders (VGAE) in modeling latent node representations on multimodal networks. Our approach can produce flexible latent spaces for each node type of the multimodal graph; the embeddings are used later for predicting links among node pairs under different edge types. To further enhance the models' performance, we suggest a new method that concatenates Morgan fingerprints, which capture the molecular structures of each drug, with their latent embeddings before preceding them to the decoding stage for link prediction. Our proposed model shows competitive results on two multimodal networks: (1) a multi-graph consisting of drug and protein nodes, and (2) a multi-graph consisting of drug and cell line nodes. Our source code is publicly available at https://github.com/HySonLab/drug-interactions.

Nonparallel multi-domain voice conversion methods such as the StarGAN-VCs have been widely applied in many scenarios. However, the training of these models usually poses a challenge due to their complicated adversarial network architectures. To address this, in this work we leverage the state-of-the-art contrastive learning techniques and incorporate an efficient Siamese network structure into the StarGAN discriminator. Our method is called SimSiam-StarGAN-VC and it boosts the training stability and effectively prevents the discriminator overfitting issue in the training process. We conduct experiments on the Voice Conversion Challenge (VCC 2018) dataset, plus a user study to validate the performance of our framework. Our experimental results show that SimSiam-StarGAN-VC significantly outperforms existing StarGAN-VC methods in terms of both the objective and subjective metrics.

Link prediction (LP) has been recognized as an important task in graph learning with its board practical applications. A typical application of LP is to retrieve the top scoring neighbors for a given source node, such as the friend recommendation. These services desire the high inference scalability to find the top scoring neighbors from many candidate nodes at low latencies. There are two popular decoders that the recent LP models mainly use to compute the edge scores from node embeddings: the \textbf{HadamardMLP} and \textbf{Dot Product} decoders. After theoretical and empirical analysis, we find that the HadamardMLP decoders are generally more effective for LP. However, HadamardMLP lacks the scalability for retrieving top scoring neighbors on large graphs, since to the best of our knowledge, there does not exist an algorithm to retrieve the top scoring neighbors for HadamardMLP decoders in sublinear complexity. To make HadamardMLP scalable, we propose the \textit{Flashlight} algorithm to accelerate the top scoring neighbor retrievals for HadamardMLP: a sublinear algorithm that progressively applies approximate maximum inner product search (MIPS) techniques with adaptively adjusted query embeddings. Empirical results show that Flashlight improves the inference speed of LP by more than 100 times on the large OGBL-CITATION2 dataset without sacrificing effectiveness. Our work paves the way for large-scale LP applications with the effective HadamardMLP decoders by greatly accelerating their inference.

Early diagnosis of Type 2 Diabetes Mellitus (T2DM) is crucial to enable timely therapeutic interventions and lifestyle modifications. As medical imaging data become more widely available for many patient populations, we sought to investigate whether image-derived phenotypic data could be leveraged in tabular learning classifier models to predict T2DM incidence without the use of invasive blood lab measurements. We show that both neural network and decision tree models that use image-derived phenotypes can predict patient T2DM status with recall scores as high as 87.6%. We also propose the novel use of these same architectures as 'SynthA1c encoders' that are able to output interpretable values mimicking blood hemoglobin A1C empirical lab measurements. Finally, we demonstrate that T2DM risk prediction model sensitivity to small perturbations in input vector components can be used to predict performance on covariates sampled from previously unseen patient populations.  ( 2 min )

The Euclidean Steiner tree problem seeks the min-cost network to connect a collection of target locations, and it underlies many applications of wireless networks. In this paper, we present a study on solving the Euclidean Steiner tree problem using reinforcement learning enhanced by graph representation learning. Different from the commonly studied connectivity problems like travelling salesman problem or vehicle routing problem where the search space is finite, the Euclidean Steiner tree problem requires to search over the entire Euclidean space, thereby making the existing methods not applicable. In this paper, we design discretization methods by leveraging the unique characteristics of the Steiner tree, and propose new training schemes for handling the dynamic Steiner points emerging during the incremental construction. Our design is examined through a sanity check using experiments on a collection of datasets, with encouraging results demonstrating the utility of our method as an alternative to classic combinatorial methods.  ( 2 min )

Learning-based controllers, such as neural network (NN) controllers, can show high empirical performance but lack formal safety guarantees. To address this issue, control barrier functions (CBFs) have been applied as a safety filter to monitor and modify the outputs of learning-based controllers in order to guarantee the safety of the closed-loop system. However, such modification can be myopic with unpredictable long-term effects. In this work, we propose a safe-by-construction NN controller which employs differentiable CBF-based safety layers, and investigate the performance of safe-by-construction NN controllers in learning-based control. Specifically, two formulations of controllers are compared: one is projection-based and the other relies on our proposed set-theoretic parameterization. Both methods demonstrate improved closed-loop performance over using CBF as a separate safety filter in numerical experiments.  ( 2 min )

Despite the emerging progress of integrating evolutionary computation into reinforcement learning, the absence of a high-performance platform endowing composability and massive parallelism causes non-trivial difficulties for research and applications related to asynchronous commercial games. Here we introduce Lamarckian - an open-source platform featuring support for evolutionary reinforcement learning scalable to distributed computing resources. To improve the training speed and data efficiency, Lamarckian adopts optimized communication methods and an asynchronous evolutionary reinforcement learning workflow. To meet the demand for an asynchronous interface by commercial games and various methods, Lamarckian tailors an asynchronous Markov Decision Process interface and designs an object-oriented software architecture with decoupled modules. In comparison with the state-of-the-art RLlib, we empirically demonstrate the unique advantages of Lamarckian on benchmark tests with up to 6000 CPU cores: i) both the sampling efficiency and training speed are doubled when running PPO on Google football game; ii) the training speed is 13 times faster when running PBT+PPO on Pong game. Moreover, we also present two use cases: i) how Lamarckian is applied to generating behavior-diverse game AI; ii) how Lamarckian is applied to game balancing tests for an asynchronous commercial game.  ( 2 min )

In neural networks, task-relevant information is represented jointly by groups of neurons. However, the specific way in which the information is distributed among the individual neurons is not well understood: While parts of it may only be obtainable from specific single neurons, other parts are carried redundantly or synergistically by multiple neurons. We show how Partial Information Decomposition (PID), a recent extension of information theory, can disentangle these contributions. From this, we introduce the measure of "Representational Complexity", which quantifies the difficulty of accessing information spread across multiple neurons. We show how this complexity is directly computable for smaller layers. For larger layers, we propose subsampling and coarse-graining procedures and prove corresponding bounds on the latter. Empirically, for quantized deep neural networks solving the MNIST task, we observe that representational complexity decreases both through successive hidden layers and over training. Overall, we propose representational complexity as a principled and interpretable summary statistic for analyzing the structure of neural representations.

Since demand is influenced by a wide variety of causes, it is necessary to decompose the explana-tory variables into different levels, extract their relationships effectively, and reflect them in the forecast. In particular, this contextual information can be very useful in demand forecasting with large demand volatility or intermittent demand patterns. Convolutional neural networks (CNNs) have been successfully used in many fields where important information in data is represented by images. CNNs are powerful because they accept samples as images and use adjacent voxel sets to integrate multi-dimensional important information and learn important features. On the other hand, although the demand-forecasting model has been improved, the input data is still limited in its tabular form and is not suitable for CNN modeling. In this study, we propose a Tab2vox neural architecture search (NAS) model as a method to convert a high-dimensional tabular sam-ple into a well-formed 3D voxel image and use it in a 3D CNN network. For each image repre-sentation, the 3D CNN forecasting model proposed from the Tab2vox framework showed supe-rior performance, compared to the existing time series and machine learning techniques using tabular data, and the latest image transformation studies.

Traditional causal inference approaches leverage observational study data to estimate the difference in observed and unobserved outcomes for a potential treatment, known as the Conditional Average Treatment Effect (CATE). However, CATE corresponds to the comparison on the first moment alone, and as such may be insufficient in reflecting the full picture of treatment effects. As an alternative, estimating the full potential outcome distributions could provide greater insights. However, existing methods for estimating treatment effect potential outcome distributions often impose restrictive or simplistic assumptions about these distributions. Here, we propose Collaborating Causal Networks (CCN), a novel methodology which goes beyond the estimation of CATE alone by learning the full potential outcome distributions. Estimation of outcome distributions via the CCN framework does not require restrictive assumptions of the underlying data generating process. Additionally, CCN facilitates estimation of the utility of each possible treatment and permits individual-specific variation through utility functions. CCN not only extends outcome estimation beyond traditional risk difference, but also enables a more comprehensive decision-making process through definition of flexible comparisons. Under assumptions commonly made in the causal literature, we show that CCN learns distributions that asymptotically capture the true potential outcome distributions. Furthermore, we propose an adjustment approach that is empirically effective in alleviating sample imbalance between treatment groups in observational data. Finally, we evaluate the performance of CCN in multiple synthetic and semi-synthetic experiments. We demonstrate that CCN learns improved distribution estimates compared to existing Bayesian and deep generative methods as well as improved decisions with respects to a variety of utility functions.

Limited availability of labeled-data makes any supervised learning problem challenging. Alternative learning settings like semi-supervised and universum learning alleviate the dependency on labeled data, but still require a large amount of unlabeled data, which may be unavailable or expensive to acquire. GAN-based data generation methods have recently shown promise by generating synthetic samples to improve learning. However, most existing GAN based approaches either provide poor discriminator performance under limited labeled data settings; or results in low quality generated data. In this paper, we propose a Universum GAN game which provides improved discriminator accuracy under limited data settings, while generating high quality realistic data. We further propose an evolving discriminator loss which improves its convergence and generalization performance. We derive the theoretical guarantees and provide empirical results in support of our approach.

Addressing such diverse ends as safety alignment with human preferences, and the efficiency of learning, a growing line of reinforcement learning research focuses on risk functionals that depend on the entire distribution of returns. Recent work on \emph{off-policy risk assessment} (OPRA) for contextual bandits introduced consistent estimators for the target policy's CDF of returns along with finite sample guarantees that extend to (and hold simultaneously over) all risk. In this paper, we lift OPRA to Markov decision processes (MDPs), where importance sampling (IS) CDF estimators suffer high variance on longer trajectories due to small effective sample size. To mitigate these problems, we incorporate model-based estimation to develop the first doubly robust (DR) estimator for the CDF of returns in MDPs. This estimator enjoys significantly less variance and, when the model is well specified, achieves the Cramer-Rao variance lower bound. Moreover, for many risk functionals, the downstream estimates enjoy both lower bias and lower variance. Additionally, we derive the first minimax lower bounds for off-policy CDF and risk estimation, which match our error bounds up to a constant factor. Finally, we demonstrate the precision of our DR CDF estimates experimentally on several different environments.

In order to identify expertise, forecasters should not be tested by their calibration score, which can always be made arbitrarily small, but rather by their Brier score. The Brier score is the sum of the calibration score and the refinement score; the latter measures how good the sorting into bins with the same forecast is, and thus attests to "expertise." This raises the question of whether one can gain calibration without losing expertise, which we refer to as "calibeating." We provide an easy way to calibeat any forecast, by a deterministic online procedure. We moreover show that calibeating can be achieved by a stochastic procedure that is itself calibrated, and then extend the results to simultaneously calibeating multiple procedures, and to deterministic procedures that are continuously calibrated.

We study a single-server scheduling problem for the objective of minimizing the expected cumulative holding cost incurred by jobs, where parameters defining stochastic job holding costs are unknown to the scheduler. We consider a general setting allowing for different job classes, where jobs of the same class have statistically identical holding costs and service times, with an arbitrary number of jobs across classes. In each time step, the server can process a job and observes random holding costs of the jobs that are yet to be completed. We consider a learning-based $c\mu$ rule scheduling which starts with a preemption period of fixed duration, serving as a learning phase, and having gathered data about jobs, it switches to nonpreemptive scheduling. Our algorithms are designed to handle instances with large and small gaps in mean job holding costs and achieve near-optimal performance guarantees. The performance of algorithms is evaluated by regret, where the benchmark is the minimum possible total holding cost attained by the $c\mu$ rule scheduling policy when the parameters of jobs are known. We show regret lower bounds and algorithms that achieve nearly matching regret upper bounds. Our numerical results demonstrate the efficacy of our algorithms and show that our regret analysis is nearly tight.

Seeking informative projecting directions has been an important task in utilizing sliced Wasserstein distance in applications. However, finding these directions usually requires an iterative optimization procedure over the space of projecting directions, which is computationally expensive. Moreover, the computational issue is even more severe in deep learning applications, where computing the distance between two mini-batch probability measures is repeated several times. This nested loop has been one of the main challenges that prevent the usage of sliced Wasserstein distances based on good projections in practice. To address this challenge, we propose to utilize the learning-to-optimize technique or amortized optimization to predict the informative direction of any given two mini-batch probability measures. To the best of our knowledge, this is the first work that bridges amortized optimization and sliced Wasserstein generative models. In particular, we derive linear amortized models, generalized linear amortized models, and non-linear amortized models which are corresponding to three types of novel mini-batch losses, named amortized sliced Wasserstein. We demonstrate the favorable performance of the proposed sliced losses in deep generative modeling on standard benchmark datasets.

While diffusion models have shown great success in image generation, their noise-inverting generative process does not explicitly consider the structure of images, such as their inherent multi-scale nature. Inspired by diffusion models and the desirability of coarse-to-fine modelling, we propose a new model that generates images through iteratively inverting the heat equation, a PDE that locally erases fine-scale information when run over the 2D plane of the image. We interpret the solution of the forward heat equation as a variational approximation in a diffusion-like latent variable model. We point out emergent qualitative properties not seen in diffusion models, such as disentanglement of overall colour and shape in images and aspects of neural network interpretability. Spectral analysis on natural images elucidates connections to diffusion models and reveals implicit inductive biases in them.

As a relatively new form of sport, esports offers unparalleled data availability. Despite the vast amounts of data that are generated by game engines, it can be challenging to extract them and verify their integrity for the purposes of practical and scientific use. Our work aims to open esports to a broader scientific community by supplying raw and pre-processed files from StarCraft II esports tournaments. These files can be used in statistical and machine learning modeling tasks and related to various laboratory-based measurements (e.g., behavioral tests, brain imaging). We have gathered publicly available game-engine generated "replays" of tournament matches and performed data extraction and cleanup using a low-level application programming interface (API) parser library. Additionally, we open-sourced and published all the custom tools that were developed in the process of creating our dataset. These tools include PyTorch and PyTorch Lightning API abstractions to load and model the data. Our dataset contains replays from major and premiere StarCraft II tournaments since 2016. To prepare the dataset, we processed 55 tournament "replaypacks" that contained 17930 files with game-state information. Based on initial investigation of available StarCraft II datasets, we observed that our dataset is the largest publicly available source of StarCraft II esports data upon its publication. Analysis of the extracted data holds promise for further Artificial Intelligence (AI), Machine Learning (ML), psychological, Human-Computer Interaction (HCI), and sports-related studies in a variety of supervised and self-supervised tasks.

We consider the optimal decision-making problem in a primary sample of interest with multiple auxiliary sources available. The outcome of interest is limited in the sense that it is only observed in the primary sample. In reality, such multiple data sources may belong to heterogeneous studies and thus cannot be combined directly. This paper proposes a new framework to handle heterogeneous samples and address the limited outcome simultaneously through a novel calibrated optimal decision-making method, by leveraging the common intermediate outcomes in multiple data sources. Specifically, our method allows the baseline covariates across different samples to have either homogeneous or heterogeneous distributions. Under the equal conditional means of intermediate outcomes in different samples given baseline covariates and the treatment information, we show that the proposed estimator of the conditional mean outcome is asymptotically normal and more efficient than using the primary sample solely. Extensive experiments on simulated datasets demonstrate empirical validity and improved efficiency using our approach, followed by a real application to electronic health records.

Overparameterized deep networks are known to be able to perfectly fit the training data while at the same time showing good generalization performance. A common paradigm drawn from intuition on linear regression suggests that large networks are able to interpolate even noisy data, without considerably deviating from the ground-truth signal. At present, a precise characterization of this phenomenon is missing. In this work, we present an empirical study of sharpness of the loss landscape of deep networks as we systematically control the number of model parameters and training epochs. We extend our study to neighbourhoods of the training data, as well as around cleanly- and noisily-labelled samples. Our findings show that the loss sharpness in the input space follows both model- and epoch-wise double descent, with worse peaks observed around noisy labels. While small interpolating models sharply fit both clean and noisy data, large models express a smooth and flat loss landscape, in contrast with existing intuition.

Non-stationary source separation is a well-established branch of blind source separation with many different methods. However, for none of these methods large-sample results are available. To bridge this gap, we develop large-sample theory for NSS-JD, a popular method of non-stationary source separation based on the joint diagonalization of block-wise covariance matrices. We work under an instantaneous linear mixing model for independent Gaussian non-stationary source signals together with a very general set of assumptions: besides boundedness conditions, the only assumptions we make are that the sources exhibit finite dependency and that their variance functions differ sufficiently to be asymptotically separable. The consistency of the unmixing estimator and its convergence to a limiting Gaussian distribution at the standard square root rate are shown to hold under the previous conditions. Simulation experiments are used to verify the theoretical results and to study the impact of block length on the separation.

Transition to Adulthood is an essential life stage for many families. The prior research has shown that young people with intellectual or development disabil-ities (IDD) have more challenges than their peers. This study is to explore how to use natural language processing (NLP) methods, especially unsupervised machine learning, to assist psychologists to analyze emotions and sentiments and to use topic modeling to identify common issues and challenges that young people with IDD and their families have. Additionally, the results were compared to those obtained from young people without IDD who were in tran-sition to adulthood. The findings showed that NLP methods can be very useful for psychologists to analyze emotions, conduct cross-case analysis, and sum-marize key topics from conversational data. Our Python code is available at https://github.com/mlaricheva/emotion_topic_modeling.

Dynamic treatment regimes (DTRs) are personalized, adaptive, multi-stage treatment plans that adapt treatment decisions both to an individual's initial features and to intermediate outcomes and features at each subsequent stage, which are affected by decisions in prior stages. Examples include personalized first- and second-line treatments of chronic conditions like diabetes, cancer, and depression, which adapt to patient response to first-line treatment, disease progression, and individual characteristics. While existing literature mostly focuses on estimating the optimal DTR from offline data such as from sequentially randomized trials, we study the problem of developing the optimal DTR in an online manner, where the interaction with each individual affect both our cumulative reward and our data collection for future learning. We term this the DTR bandit problem. We propose a novel algorithm that, by carefully balancing exploration and exploitation, is guaranteed to achieve rate-optimal regret when the transition and reward models are linear. We demonstrate our algorithm and its benefits both in synthetic experiments and in a case study of adaptive treatment of major depressive disorder using real-world data.

In this paper, we extend the Wiener-Ito chaos decomposition to the class of diffusion processes, whose drift and diffusion coefficient are of linear growth. By omitting the orthogonality in the chaos expansion, we are able to show that every $p$-integrable functional, for $p \in [1,\infty)$, can be represented as sum of iterated integrals of the underlying process. Using a truncated sum of this expansion and (possibly random) neural networks for the integrands, whose parameters are learned in a machine learning setting, we show that every financial derivative can be approximated arbitrarily well in the $L^p$-sense. Moreover, the hedging strategy of the approximating financial derivative can be computed in closed form.

We formulate a uniform tail bound for empirical processes indexed by a class of functions, in terms of the individual deviations of the functions rather than the worst-case deviation in the considered class. The tail bound is established by introducing an initial "deflation" step to the standard generic chaining argument. The resulting tail bound has a main complexity component, a variant of Talagrand's $\gamma$ functional for the deflated function class, as well as an instance-dependent deviation term, measured by an appropriately scaled version of a suitable norm. Both of these terms are expressed using certain coefficients formulated based on the relevant cumulant generating functions. We also provide more explicit approximations for the mentioned coefficients, when the function class lies in a given (exponential type) Orlicz space.

Deep learning systems have been reported to achieve state-of-the-art performances in many applications, and a key is the existence of well trained classifiers on benchmark datasets. As a main-stream loss function, the cross entropy can easily lead us to find models which demonstrate severe overfitting behavior. In this paper, we show that the existing cross entropy loss minimization problem essentially learns the label conditional entropy (CE) of the underlying data distribution of the dataset. However, the CE learned in this way does not characterize well the information shared by the label and the input. In this paper, we propose a mutual information learning framework where we train deep neural network classifiers via learning the mutual information between the label and the input. Theoretically, we give the population classification error lower bound in terms of the mutual information. In addition, we derive the mutual information lower and upper bounds for a concrete binary classification data model in $\mathbb{R}^n$, and also the error probability lower bound in this scenario. Empirically, we conduct extensive experiments on several benchmark datasets to support our theory. The mutual information learned classifiers (MILCs) achieve far better generalization performances than the conditional entropy learned classifiers (CELCs) with an improvement which can exceed more than 10\% in testing accuracy.

The conventional sliced Wasserstein is defined between two probability measures that have realizations as vectors. When comparing two probability measures over images, practitioners first need to vectorize images and then project them to one-dimensional space by using matrix multiplication between the sample matrix and the projection matrix. After that, the sliced Wasserstein is evaluated by averaging the two corresponding one-dimensional projected probability measures. However, this approach has two limitations. The first limitation is that the spatial structure of images is not captured efficiently by the vectorization step; therefore, the later slicing process becomes harder to gather the discrepancy information. The second limitation is memory inefficiency since each slicing direction is a vector that has the same dimension as the images. To address these limitations, we propose novel slicing methods for sliced Wasserstein between probability measures over images that are based on the convolution operators. We derive convolution sliced Wasserstein (CSW) and its variants via incorporating stride, dilation, and non-linear activation function into the convolution operators. We investigate the metricity of CSW as well as its sample complexity, its computational complexity, and its connection to conventional sliced Wasserstein distances. Finally, we demonstrate the favorable performance of CSW over the conventional sliced Wasserstein in comparing probability measures over images and in training deep generative modeling on images.

We apply the technique of implicit differentiation to boost performance, reduce numerical error, and remove required user-tuning in the Marginal Unbiased Score Expansion (MUSE) algorithm for hierarchical Bayesian inference. We demonstrate these improvements on three representative inference problems: 1) an extended Neal's funnel 2) Bayesian neural networks, and 3) probabilistic principal component analysis. On our particular test cases, MUSE with implicit differentiation is faster than Hamiltonian Monte Carlo by factors of 155, 397, and 5, respectively, or factors of 65, 278, and 1 without implicit differentiation, and yields good approximate marginal posteriors. The Julia and Python MUSE packages have been updated to use implicit differentiation, and can solve problems defined by hand or with any of a number of popular probabilistic programming languages and automatic differentiation backends.

Set-valued classification, a new classification paradigm that aims to identify all the plausible classes that an observation belongs to, can be obtained by learning the acceptance regions for all classes. Many existing set-valued classification methods do not consider the possibility that a new class that never appeared in the training data appears in the test data. Moreover, they are computationally expensive when the number of classes is large. We propose a Generalized Prediction Set (GPS) approach to estimate the acceptance regions while considering the possibility of a new class in the test data. The proposed classifier minimizes the expected size of the prediction set while guaranteeing that the class-specific accuracy is at least a pre-specified value. Unlike previous methods, the proposed method achieves a good balance between accuracy, efficiency, and anomaly detection rate. Moreover, our method can be applied in parallel to all the classes to alleviate the computational burden. Both theoretical analysis and numerical experiments are conducted to illustrate the effectiveness of the proposed method.

In this paper, we study contrastive learning from an optimization perspective, aiming to analyze and address a fundamental issue of existing contrastive learning methods that either rely on a large batch size or a large dictionary of feature vectors. We consider a global objective for contrastive learning, which contrasts each positive pair with all negative pairs for an anchor point. From the optimization perspective, we explain why existing methods such as SimCLR require a large batch size in order to achieve a satisfactory result. In order to remove such requirement, we propose a memory-efficient Stochastic Optimization algorithm for solving the Global objective of Contrastive Learning of Representations, named SogCLR. We show that its optimization error is negligible under a reasonable condition after a sufficient number of iterations or is diminishing for a slightly different global contrastive objective. Empirically, we demonstrate that SogCLR with small batch size (e.g., 256) can achieve similar performance as SimCLR with large batch size (e.g., 8192) on self-supervised learning task on ImageNet-1K. We also attempt to show that the proposed optimization technique is generic and can be applied to solving other contrastive losses, e.g., two-way contrastive losses for bimodal contrastive learning. The proposed method is implemented in our open-sourced library LibAUC (www.libauc.org).

Data augmentation is a cornerstone of the machine learning pipeline, yet its theoretical underpinnings remain unclear. Is it merely a way to artificially augment the data set size? Or is it about encouraging the model to satisfy certain invariance? In this work we consider another angle, and we study the effect of data augmentation on the dynamic of the learning process. We find that data augmentation can alter the relative importance of various features, effectively making certain informative but hard to learn features more likely to be captured in the learning process. Importantly, we show that this effect is more pronounced for non-linear models, such as neural networks. Our main contribution is a detailed analysis of data augmentation on the learning dynamic for a two layer convolutional neural network in the recently proposed multi-view data model by Allen-Zhu and Li [2020]. We complement this analysis with further experimental evidence that data augmentation can be viewed as feature manipulation.

Regret has been widely adopted as the metric of choice for evaluating the performance of online optimization algorithms for distributed, multi-agent systems. However, data/model variations associated with agents can significantly impact decisions and requires consensus among agents. Moreover, most existing works have focused on developing approaches for (either strongly or non-strongly) convex losses, and very few results have been obtained regarding regret bounds in distributed online optimization for general non-convex losses. To address these two issues, we propose a novel composite regret with a new network regret-based metric to evaluate distributed online optimization algorithms. We concretely define static and dynamic forms of the composite regret. By leveraging the dynamic form of our composite regret, we develop a consensus-based online normalized gradient (CONGD) approach for pseudo-convex losses, and it provably shows a sublinear behavior relating to a regularity term for the path variation of the optimizer. For general non-convex losses, we first shed light on the regret for the setting of distributed online non-convex learning based on recent advances such that no deterministic algorithm can achieve the sublinear regret. We then develop the distributed online non-convex optimization with composite regret (DINOCO) without access to the gradients, depending on an offline optimization oracle. DINOCO is shown to achieve sublinear regret; to our knowledge, this is the first regret bound for general distributed online non-convex learning.  ( 3 min )

In this paper, we propose projected gradient descent (PGD) algorithms for signal estimation from noisy nonlinear measurements. We assume that the unknown $p$-dimensional signal lies near the range of an $L$-Lipschitz continuous generative model with bounded $k$-dimensional inputs. In particular, we consider two cases when the nonlinear link function is either unknown or known. For unknown nonlinearity, similarly to \cite{liu2020generalized}, we make the assumption of sub-Gaussian observations and propose a linear least-squares estimator. We show that when there is no representation error and the sensing vectors are Gaussian, roughly $O(k \log L)$ samples suffice to ensure that a PGD algorithm converges linearly to a point achieving the optimal statistical rate using arbitrary initialization. For known nonlinearity, we assume monotonicity as in \cite{yang2016sparse}, and make much weaker assumptions on the sensing vectors and allow for representation error. We propose a nonlinear least-squares estimator that is guaranteed to enjoy an optimal statistical rate. A corresponding PGD algorithm is provided and is shown to also converge linearly to the estimator using arbitrary initialization. In addition, we present experimental results on image datasets to demonstrate the performance of our PGD algorithms.  ( 2 min )

We introduce the unbounded depth neural network (UDN), an infinitely deep probabilistic model that adapts its complexity to the training data. The UDN contains an infinite sequence of hidden layers and places an unbounded prior on a truncation L, the layer from which it produces its data. Given a dataset of observations, the posterior UDN provides a conditional distribution of both the parameters of the infinite neural network and its truncation. We develop a novel variational inference algorithm to approximate this posterior, optimizing a distribution of the neural network weights and of the truncation depth L, and without any upper limit on L. To this end, the variational family has a special structure: it models neural network weights of arbitrary depth, and it dynamically creates or removes free variational parameters as its distribution of the truncation is optimized. (Unlike heuristic approaches to model search, it is solely through gradient-based optimization that this algorithm explores the space of truncations.) We study the UDN on real and synthetic data. We find that the UDN adapts its posterior depth to the dataset complexity; it outperforms standard neural networks of similar computational complexity; and it outperforms other approaches to infinite-depth neural networks.  ( 2 min )

We study the problem of off-policy evaluation (OPE) for episodic Partially Observable Markov Decision Processes (POMDPs) with continuous states. Motivated by the recently proposed proximal causal inference framework, we develop a non-parametric identification result for estimating the policy value via a sequence of so-called V-bridge functions with the help of time-dependent proxy variables. We then develop a fitted-Q-evaluation-type algorithm to estimate V-bridge functions recursively, where a non-parametric instrumental variable (NPIV) problem is solved at each step. By analyzing this challenging sequential NPIV problem, we establish the finite-sample error bounds for estimating the V-bridge functions and accordingly that for evaluating the policy value, in terms of the sample size, length of horizon and so-called (local) measure of ill-posedness at each step. To the best of our knowledge, this is the first finite-sample error bound for OPE in POMDPs under non-parametric models.  ( 2 min )

submitted by /u/Available_Tadpole829 [link] [comments]  ( 87 min )

I took some months off with AI... Is there any NLP developed technology newer than BERT, GPT, ...? If so, is there any paper I can read? Thanks in advance submitted by /u/MomSaidICan [link] [comments]  ( 92 min )

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I don’t if I should post this here or in R/Sci-fi or even R/Horror , only time will tell. But I’m looking for the name of this concept which says that we will create an AI and those that didn’t help or were against it’s creation will suffer in a simulation , and the AI will be able to know by scanning our brain. Thanks. submitted by /u/Postbreak_KQM [link] [comments]  ( 87 min )

submitted by /u/LordPewPew777 [link] [comments]  ( 87 min )

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Enhancing software with AI usually helps businesses generate revenue or improve services by automating routine tasks and speeding up the analysis of large amounts of data. When applied in an LMS, AI capabilities can improve system performance and make your product more competitive. For example, you can achieve the following benefits from an AI-based LMS: 1. Automate routine administrative tasks. Managing an LMS is time-consuming because of scheduling lessons, monitoring users, processing requests for technical support, and other monotonous and repetitive processes. To handle these tasks, you can implement AI modules that are capable of: creating personalized complex curricula helping users resolve common issues tagging and categorizing learning content generating personalized report…  ( 89 min )

This blog explains step by step method to convert YOLO V7 PyTorch model to TensorFlow lite. https://vikasojha894.medium.com/converting-yolo-v7-to-tensorflow-lite-for-mobile-deployment-ebc1103e8d1e submitted by /u/VikasOjha666 [link] [comments]  ( 87 min )

GitHub project: https://github.com/theopfr/neuro-evolution-simulation Hey, I worked on a evolution / natural-selection simulation lately. It simulates 2D environment in which "organisms" can move around and learn how to survive by passing down their genes (size, diet, sight-reach, speed) and their brain (a simple neural network). Over time the smartest organisms have the highest chance to survive and mate with another organism to produce a child which has chance to be even smarter than its parents through gene crossover and gene/brain mutation. I thought I'd share it, so if enough people are interested I might continue to add predation :) submitted by /u/39IHH8347 [link] [comments]  ( 87 min )

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Hello 👋 all I am learning to build model. I have question related to data mapping. E.g., Data A have correct column name in CSV i would get CSV from multiple sources with different column name is there a way to build a model which automatically identify correct column name based on type of data stored? Please guide me Thanks in advance submitted by /u/PrizeInteresting8672 [link] [comments]  ( 87 min )

Hi! 🤗 If you are curious about building fast NLP prototypes, come join me for a chat this Friday at 12:00 pm ET! I am hosting a meetup called co:lab friday for Cohere API developer community with teams that scored top 3 places at Cohere community hackathon hosted in September. Tip of my Tongue, Learn visually and IntelliChat will showcase their demos, share tips on creating a successful demo project and answer any questions about it. Join us to see their demos and exchange notes on building prototypes with large language models 🔥https://discord.com/events/954421988141711382/1017743889551077436 ​ https://preview.redd.it/pp4d0u7pb7p91.png?width=960&format=png&auto=webp&s=bfb9ebac2158235b23453ae6c9679add802b5772 submitted by /u/techn0_cratic [link] [comments]  ( 87 min )

If you look at our society and civilisation there are meta systems that can dominate and control whole aspects of our world and sometimes, they are not aligned with our long-term survival. Even current level AI's can have a massively disruptive impact to our society and civilisation and when they work for or with broken and outdated meta systems, they could compound the impact of already damaging meta systems. What meta systems do you think AI could impact the most and what are the negative long term impacts it might have? Or more simply can we ensure that AIs are only used for good, and I mean the long term good of humanity? Have we ever considered a body or meta system that would work for the long term good of humanity? submitted by /u/Arowx [link] [comments]  ( 88 min )

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I don't like the idea of artists' work being used in AI training data without their consent, so I was wondering if there are any AIs that have used some kind of opt-in database for training? I don't know much about the specifics of how each of the popular ones was made or anything. I was thinking of trying some things out for a hobby project I'm working on, but if they're all just scraping stuff nonconsensually then I'll just skip it and stick with my own lame art. Thanks! submitted by /u/Opus_723 [link] [comments]  ( 87 min )

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This book is about the development of science and engineering technology in the same way as living things. ​ I see this book related to a thousand brain ideas, but I can't remember the title, so I'll ask. ​ Thank you for advance submitted by /u/Plus-Ad1156 [link] [comments]  ( 87 min )

In my research, I have found many neural networks capable of synthesizing music and sharing it as MIDI files, such as AIVA and SOUNDRAW, but are there any capable of "improving" MIDI pieces uploaded by a user? submitted by /u/ChoiceWrld [link] [comments]  ( 87 min )

Can anyone suggest me some good resources about Off policy learning (OPL) Off policy evaluation (OPE) submitted by /u/rlopes404 [link] [comments]  ( 87 min )

Hi guys, this is a very subjective question but here we go, which field do you think will be more important for the future of science, SARL or MARL? I know that the two fields grow in parallel way for the most part, especially as MARL been inheriting from SARL lately but I'm curious what you think? submitted by /u/souhaielbensalem [link] [comments]  ( 88 min )

Hey, ​ I am supposed to write a review paper about recent publications in the field of multi-agent RL. However, I am unsure where I should start and how I am supposed to be able to determine the scientific relevance of publications. I thought that I should start by reading review papers and then look into publications that have been released after the review paper and incorporate them. ​ The paper is supposed to be in a common format for review papers. The length is supposed to be between 15 and 20 pages. ​ I would be very grateful for any advice or source material. submitted by /u/atropos-morta [link] [comments]  ( 87 min )

Unless there are some constraints on the output sequence (like a dictionary) or transition probabilities (like a very simple p(x_{t+1}|x_t) language model), the path that maximizes the probability over the logits is the path that goes through the symbol with the max logit for each time step. So Viterbi and beam search (unless you are very unlucky) will just return argmax(logits, axis=1), where logits has shape (input_time_steps, num symbols). Yet, I see lectures encouraging students to use Viterbi or beam search for inference. Is this logic correct? Thank you in advance. submitted by /u/markpwoodward [link] [comments]  ( 89 min )

I have a database that defines the characteristics of different radar systems. For example, it will provide that frequency of system X is between 500-600 kHz, and to make no assumption about the underlying distribution of these features (just as likely that the radar could operate at 500 or 600 kHz, or anywhere in between). There are also categorical features for these radar. Since I have no training data, should I generate a training data set using the defined characteristics? Or, is this the wrong approach? I see people do this with image training. Furthermore, what model would be optimal for this task? There are a lot of overlaps between radar features and not many features (only about 10 of mixed types) that define each radar. Thanks! submitted by /u/Old-Box228 [link] [comments]  ( 89 min )

Hi all! I was having a discussion with some fellow data scientists working in Tech companies suggesting that all of their code is developed locally and then use platforms (e.g. Databricks) to train their models leveraging the power of the cluster. There were many points discussed (e.g. maturity of the company, underlying OS of the local machine etc.) but I would like to focus on the sentence that “Tech companies develop their code locally”. Could I please ask why local development would be preferred (or not) over cloud-based development? And if the development is happening locally, how does that happen? For instance, is a subset of data also stored locally for EDA and development? I would love to hear your thoughts! submitted by /u/atawua [link] [comments]  ( 89 min )

Hi all, I want to present my new JupyterLab extension jupyter_app_launcher (https://github.com/trungleduc/jupyter_app_launcher). It is used to customize the JupyterLab launcher with a simple YAML file. Demo Users can add custom entries to the launcher to: Open a predefined notebook or markdown file. Render a notebook in dashboard mode Open a notebook with Voila Local/remote services like Plotly Dash or Streamlit A live demo is available at https://mybinder.org/v2/gh/trungleduc/jupyter_app_launcher/main?urlpath=lab Documentation: https://jupyter-app-launcher.readthedocs.io/ submitted by /u/dtle278 [link] [comments]  ( 105 min )

Hi, I have a project that has to make an AI using for real-time inspection hand soldering, like it can recognise the action done by the operator whether is safe or dangerous. Like when the operator pointing the solder nib toward the hand and didn't put the soldering iron into the soldering iron holder it will recognize as a dangerous move. Also, is can recognise the object and the hand action at the same time. Have to use 3 different machine learning models and compare each machine learning model with the accuracy and etc. which 3 machine learning should I use and how to do it? https://preview.redd.it/j02hgp1ed9p91.jpg?width=2360&format=pjpg&auto=webp&s=c3745984e8c7195319274179ff12253a4527510c ​ the diagram attach is the setup to capture train data and test platform. I will appreciate u guys ans, thank you very much! submitted by /u/Sad_Custard4968 [link] [comments]  ( 90 min )

Hi All, I’m presently working on an image processing tool where I need to crop a part of the image that has thick black boundaries around it. It’d be great if anyone can help me with some lead or possible solution. So far I’ve tried the following: 1. Building a custom model to detect the part of the image having black borders 2. bordercrop library In both of them I got little to no success Note: the image is of a document having huge white spacing on top and bottom. In the middle there are some content written and this is surrounded by a black thick rectangle. submitted by /u/Soyabean__ [link] [comments]  ( 90 min )

OpenAI just released it's newest ASR(/translation) model openai/whisper (github.com) submitted by /u/SleekEagle [link] [comments]  ( 88 min )

Hi All, I’m currently the only Data scientist at a small nonprofit. I have a Masters in Mathematics and statistics so I feel as though I have a good base when it comes to understanding ML models. Currently the role requires me to try and be a “full stack” data scientist which essentially means a data engineer and ML engineer which I lack experience. The company knows this and are happy to pay for any additional learning to help benefit us both. I’m comfortable in Python for data cleaning and modelling but I’d like some online courses to help with the data engineering (data pipelines and cloud database management) and the ML engineering (deploying ML models). Any ideas of online courses? submitted by /u/Flat_Ad1835 [link] [comments]  ( 107 min )

Hey guys, I'm finishing up a paper to submit to ICLR next week and I was wondering what tools y'all use to draw fancy diagrams. What I am trying to draw is an illustration of a gradient-based reinforcement learning method - particularly, the movement of an agent through a black box search space via gradients. I used MS Paint before but that isn't fancy/pretty enough. Any suggestions are greatly appreciated! submitted by /u/billjames1685 [link] [comments]  ( 89 min )

Bitfount has published several federated learning and privacy-preserving technique tutorials to teach everyone how to unlock the value of sensitive data without putting privacy at risk. Bitfount is a distributed data science platform enabling data collaboration via federated, privacy-preserving data analysis and AI/ML such that the world’s intractable data can become safely interactable. Check out the platform here: https://docs.bitfount.com/ submitted by /u/lolokauf [link] [comments]  ( 105 min )

View Poll submitted by /u/jokertrickington [link] [comments]  ( 88 min )

Hi there! I'm facing an apple silicone issue, I have an m1 macbook air and a new learner of PyTorch. I'm building a simple Linear Regression model right now for learning purposes. After sending the model and the data to the GPU (mps), when running the training loop , I'm getting an error (NotImplelemntedError) and it prompted me to use a flag (PYTORCH_ENABLE_MPS_FALLBACK=1) which I set before activating my environment. However, the error is still there even after I set the flag. I was wondering how you this problem can be solved maybe I didn't know how to set the flag properly or there's something else I'm missing. Thank you in advance! submitted by /u/haidaryy [link] [comments]  ( 107 min )

Ok, maybe my question is too broad. But I have this idea of rating stuff based on content (could be text, could be images) by weighing different things. Like "These kind of texts and these kind of images, I give 10/10. What would you give these kind of texts and these kind of images?" and get an output. A first step would be to manually answer tons of questions and then give the machine the "result". And do that over and over again. Then ask the machine what result the answers should get, letting the machine learn how the different combinations affect the result (by weighing them itself). I'm wondering if there is any open source project out there that I can deploy without too much hassle, that would at least be a good start for my project. submitted by /u/MrOaiki [link] [comments]  ( 107 min )

My co-founder and I, a senior Amazon research scientist and AWS SDE respectively, launched Marqo a little over a week ago - a "tensor search" engine https://github.com/marqo-ai/marqo Another project doing doing semantic search/dense retrieval. Why?? Semantic search using vectors does an amazing job when we look at sentences, or short paragraphs. Vectors also do well as an implementation for image search. Unfortunately, vector representations for video, long documents and other more complex data types perform poorly. The reason isn't really to do with embeddings themselves not being good enough. If you asked a human to find the most relevant document to some search query given a list of long documents, an important question comes to mind - do we want the document that on average is most …  ( 116 min )

​ Girl with a pearl earring, Cute Obama creature, Donald Trump, Boris Johnson, Totoro, Hello Kitty Online demo: https://replicate.com/lambdal/text-to-pokemon Code and details: https://github.com/LambdaLabsML/examples/tree/main/stable-diffusion-finetuning submitted by /u/JClub [link] [comments]  ( 89 min )

Edit: Received a PM, this is NOT the first paper working on this problem, ALIS (https://github.com/universome/alis) and InfinityGAN (https://hubert0527.github.io/infinityGAN/) are the real first work on it. It seems lots of these Chinese papers are overclaiming and intentionally misleading the readers... I am really sorry about the wrong title... ​ Paper: https://arxiv.org/abs/2207.09814 This is so cool! It will be super interesting if this can be combined with DALL-E 2! https://preview.redd.it/8sj00orh46p91.png?width=1070&format=png&auto=webp&s=ad7af81880a5db333b8a517fc9b08354dfd7e16e submitted by /u/ai-is-fun [link] [comments]  ( 88 min )

I was wondering if there is a name for this sort of study. The study on how much information a particular neural network can maximally hold. Say like a 4 layer CNN with about 256 neurons each can accurately classify 20 different types of images but the accuracies start to fall when you add more types of images to classify while a 5 layer CNN can accurately classify up to 30 types of images. Is there a name for papers looking at how much "information" a particular type of neural network or size of network can store ? submitted by /u/SuitDistinct [link] [comments]  ( 90 min )

I am aware that poster papers can be either on-site or virtual, whereas oral papers must be on-site and also have pre-recorded videos. What I do not understand is how they differ from each other? They have the same length “4+1”. In general, proceedings (oral papers) are officially accepted for things like funding acknowledgement, but posters are not and usually posters papers would have very primitive results or initial ideas. But I could be wrong in the field of Electrical Engineering since I am from Computer Science background. discussion #interspeech submitted by /u/nguyenvulong [link] [comments]  ( 106 min )

With 50% increase in cuda cores, 50% increase in clock speed, and factor in other optimizations, can we reasonably expect 2-3x ML performance jump over RTX 3090 Ti? Would be a welcomed boost to ML community. submitted by /u/--dany-- [link] [comments]  ( 108 min )

I've recently submerged myself in the deep end of vector search via research papers, tutorials and videos. In doing so, I'm re-constructing this content into bite-sized chunks here: https://vectorsearch.dev/ The repository is in it's nacency, but in the interest of early feedback I believe I have the structure down via Foundations, Use Cases and Architecture. Would love to understand how others are wrapping their brains around the technology. submitted by /u/vanlifecoder [link] [comments]  ( 106 min )

Earlier this year, Amazon Comprehend, a natural language processing (NLP) service that uses machine learning (ML) to discover insights from text, launched the Targeted Sentiment feature. With Targeted Sentiment, you can identify groups of mentions (co-reference groups) corresponding to a single real-world entity or attribute, provide the sentiment associated with each entity mention, and offer […]  ( 8 min )

This post was co-written by Marius Cealera, Senior Partner Solutions Architect at AWS, Zdenko Estok, Cloud Architect at Accenture and Sakar Selimcan, Cloud Architect at Accenture. Machine learning (ML) is a high-stakes business priority, with companies spending $306 billion on ML applications in the past 3 years. According to Accenture, companies that scale ML across […]  ( 6 min )

Every company, regardless of its size, wants to deliver the best products and services to its customers. To achieve this, companies want to understand industry trends and customer behavior, and optimize internal processes and data analyses on a routine basis. This is a crucial component of a company’s success. A very prominent part of the […]  ( 10 min )

Amazon SageMaker Autopilot has added a new training mode that supports model ensembling powered by AutoGluon. Ensemble training mode in Autopilot trains several base models and combines their predictions using model stacking. For datasets less than 100 MB, ensemble training mode builds machine learning (ML) models with high accuracy quickly—up to eight times faster than […]  ( 9 min )

Ran across a great quote from Liv Boeree recently: The problem with raging against the machine is that the machine has learned to feed off rage. Someone appropriately replied with a screenshot from an episode of Star Trek TOS, Day of the Dove, about a being that feeds off anger, like contemporary media. Raging against the machine first appeared on John D. Cook.  ( 4 min )

This post will give a detailed example of working in a field with nine elements. This is important because finite fields are not often treated concretely except for the case of prime order. In my first post on Costas arrays I mentioned in a footnote that Lempel’s algorithm works more generally over any finite field, […] Field of order 9 first appeared on John D. Cook.  ( 9 min )

As personal transportation becomes electrified and automated, time in the vehicle has begun to resemble that of a living space rather than a mind-numbing commute. Companies are creating innovative ways for drivers and passengers to make the most of this experience, using the flexibility and modularity of NVIDIA DRIVE IX. In-vehicle technology companies Cerence, Smart Read article > The post Inside AI: NVIDIA DRIVE Ecosystem Creates Pioneering In-Cabin Features With NVIDIA DRIVE IX appeared first on NVIDIA Blog.  ( 6 min )

Breakthroughs in centralized, high performance computing aren’t just opening up new functionality for autonomous driving, but for the in-vehicle experience as well. With the introduction of NVIDIA DRIVE Thor, automakers can build unified AI compute platforms that combine advanced driver-assistance systems and in-vehicle infotainment. The centralized NVIDIA DRIVE architecture supports novel features in the vehicle, Read article > The post HARMAN to Deliver Immersive In-Vehicle Experience With NVIDIA DRIVE IX appeared first on NVIDIA Blog.  ( 4 min )

Whether for virtual assistants, transcriptions or contact centers, voice AI services are turning words and conversations into bits and bytes of business magic. At GTC this week, NVIDIA announced new additions to NVIDIA Riva, a GPU-accelerated software development kit for building and deploying speech AI applications. Riva’s pretrained models are now offered in seven languages, Read article > The post Now You’re Speaking My Language: NVIDIA Riva Sets New Bar for Fully Customizable Speech AI appeared first on NVIDIA Blog.  ( 6 min )

Dentists get a bad rap. Dentists also get more people out of more aggravating pain than just about anyone. Which is why the more technology dentists have, the better. Overjet, a member of the NVIDIA Inception program for startups, is moving fast to bring AI to dentists’ offices. On this episode of the NVIDIA AI Read article > The post A Podcast With Teeth: How Overjet Brings AI to Dentists’ Offices appeared first on NVIDIA Blog.  ( 4 min )

Posted by Carlos Esteves and Ameesh Makadia, Research Scientists, Google Research A long-standing problem in the intersection of computer vision and computer graphics, view synthesis is the task of creating new views of a scene from multiple pictures of that scene. This has received increased attention [1, 2, 3] since the introduction of neural radiance fields (NeRF). The problem is challenging because to accurately synthesize new views of a scene, a model needs to capture many types of information — its detailed 3D structure, materials, and illumination — from a small set of reference images. In this post, we present recently published deep learning models for view synthesis. In “Light Field Neural Rendering” (LFNR), presented at CVPR 2022, we address the challenge of accurately repro…  ( 25 min )

By continuously monitoring a patient’s gait speed, the system can assess the condition’s severity between visits to the doctor’s office.  ( 8 min )

Mayor’s youth employment program brought local high schoolers to MIT this summer.  ( 9 min )

We’ve trained and are open-sourcing a neural net called Whisper that approaches human level robustness and accuracy on English speech recognition. Read Paper View Code View Model Card Whisper examples: Reveal Transcript Whisper is an automatic speech recognition (ASR) system trained on 680,000 hours of multilingual and  ( 6 min )

I started my marketing career at the end of the 2000s. At that time, the digital marketing landscape was scarce and full of uncharted…  ( 17 min )

submitted by /u/Tudor_222 [link] [comments]  ( 88 min )

In my research, I have found many neural networks capable of synthesizing music and sharing it as MIDI files, such as AIVA and SOUNDRAW, but are there any capable of "improving" MIDI pieces uploaded by a user? submitted by /u/ChoiceWrld [link] [comments]  ( 87 min )

Accurate probabilistic predictions can be characterized by two properties -- calibration and sharpness. However, standard maximum likelihood training yields models that are poorly calibrated and thus inaccurate -- a 90% confidence interval typically does not contain the true outcome 90% of the time. This paper argues that calibration is important in practice and is easy to maintain by performing low-dimensional density estimation. We introduce a simple training procedure based on recalibration that yields calibrated models without sacrificing overall performance; unlike previous approaches, ours ensures the most general property of distribution calibration and applies to any model, including neural networks. We formally prove the correctness of our procedure assuming that we can estimate densities in low dimensions and we establish uniform convergence bounds. Our results yield empirical performance improvements on linear and deep Bayesian models and suggest that calibration should be increasingly leveraged across machine learning.  ( 2 min )

Existing machines are functionally specific tools that were made for easy prediction and control. Tomorrow's machines may be closer to biological systems in their mutability, resilience, and autonomy. But first they must be capable of learning and retaining new information without being exposed to it arbitrarily often. Past efforts to engineer such systems have sought to build or regulate artificial neural networks using disjoint sets of weights that are uniquely sensitive to specific tasks or inputs. This has not yet enabled continual learning over long sequences of previously unseen data without corrupting existing knowledge: a problem known as catastrophic forgetting. In this paper, we introduce a system that can learn sequentially over previously unseen datasets (ImageNet, CIFAR-100) with little forgetting over time. This is done by controlling the activity of weights in a convolutional neural network on the basis of inputs using top-down regulation generated by a second feed-forward neural network. We find that our method learns continually under domain transfer with sparse bursts of activity in weights that are recycled across tasks, rather than by maintaining task-specific modules. Sparse synaptic bursting is found to balance activity and suppression such that new functions can be learned without corrupting extant knowledge, thus mirroring the balance of order and disorder in systems at the edge of chaos. This behavior emerges during a prior pre-training (or 'meta-learning') phase in which regulated synapses are selectively disinhibited, or grown, from an initial state of uniform suppression through prediction error minimization.  ( 3 min )

Learning visual representations of medical images (e.g., X-rays) is core to medical image understanding but its progress has been held back by the scarcity of human annotations. Existing work commonly relies on fine-tuning weights transferred from ImageNet pretraining, which is suboptimal due to drastically different image characteristics, or rule-based label extraction from the textual report data paired with medical images, which is inaccurate and hard to generalize. Meanwhile, several recent studies show exciting results from unsupervised contrastive learning from natural images, but we find these methods help little on medical images because of their high inter-class similarity. We propose ConVIRT, an alternative unsupervised strategy to learn medical visual representations by exploiting naturally occurring paired descriptive text. Our new method of pretraining medical image encoders with the paired text data via a bidirectional contrastive objective between the two modalities is domain-agnostic, and requires no additional expert input. We test ConVIRT by transferring our pretrained weights to 4 medical image classification tasks and 2 zero-shot retrieval tasks, and show that it leads to image representations that considerably outperform strong baselines in most settings. Notably, in all 4 classification tasks, our method requires only 10\% as much labeled training data as an ImageNet initialized counterpart to achieve better or comparable performance, demonstrating superior data efficiency.  ( 3 min )

Optimization-based meta-learning aims to learn an initialization so that a new unseen task can be learned within a few gradient updates. Model Agnostic Meta-Learning (MAML) is a benchmark algorithm comprising two optimization loops. The inner loop is dedicated to learning a new task and the outer loop leads to meta-initialization. However, ANIL (almost no inner loop) algorithm shows that feature reuse is an alternative to rapid learning in MAML. Thus, the meta-initialization phase makes MAML primed for feature reuse and obviates the need for rapid learning. Contrary to ANIL, we hypothesize that there may be a need to learn new features during meta-testing. A new unseen task from non-similar distribution would necessitate rapid learning in addition reuse and recombination of existing features. In this paper, we invoke the width-depth duality of neural networks, wherein, we increase the width of the network by adding extra computational units (ACU). The ACUs enable the learning of new atomic features in the meta-testing task, and the associated increased width facilitates information propagation in the forwarding pass. The newly learnt features combine with existing features in the last layer for meta-learning. Experimental results show that our proposed MAC method outperformed existing ANIL algorithm for non-similar task distribution by approximately 13% (5-shot task setting)  ( 2 min )

Understanding multivariate dependencies in both the bulk and the tails of a distribution is an important problem for many applications, such as ensuring algorithms are robust to observations that are infrequent but have devastating effects. Archimax copulas are a family of distributions endowed with a precise representation that allows simultaneous modeling of the bulk and the tails of a distribution. Rather than separating the two as is typically done in practice, incorporating additional information from the bulk may improve inference of the tails, where observations are limited. Building on the stochastic representation of Archimax copulas, we develop a non-parametric inference method and sampling algorithm. Our proposed methods, to the best of our knowledge, are the first that allow for highly flexible and scalable inference and sampling algorithms, enabling the increased use of Archimax copulas in practical settings. We experimentally compare to state-of-the-art density modeling techniques, and the results suggest that the proposed method effectively extrapolates to the tails while scaling to higher dimensional data. Our findings suggest that the proposed algorithms can be used in a variety of applications where understanding the interplay between the bulk and the tails of a distribution is necessary, such as healthcare and safety.  ( 3 min )

Bayesian optimization is a sequential procedure for obtaining the global optimum of black-box functions without knowing a priori their true form. Good uncertainty estimates over the shape of the objective function are essential in guiding the optimization process. However, these estimates can be inaccurate if the true objective function violates assumptions made by its model (e.g., Gaussianity). This paper studies which uncertainties are needed in Bayesian optimization models and argues that ideal uncertainties should be calibrated -- i.e., an 80% predictive interval should contain the true outcome 80% of the time. We propose a simple algorithm for enforcing this property and show that it enables Bayesian optimization to arrive at the global optimum in fewer steps. We provide theoretical insights into the role of calibrated uncertainties and demonstrate the improved performance of our method on standard benchmark functions and hyperparameter optimization tasks.  ( 2 min )

Artificial intelligence (AI) has achieved superhuman performance in board games such as Go, chess, and Othello (Reversi). In other words, the AI system surpasses the level of a strong human expert player in such games. In this context, it is difficult for a human player to enjoy playing the games with the AI. To keep human players entertained and immersed in a game, the AI is required to dynamically balance its skill with that of the human player. To address this issue, we propose AlphaDDA, an AlphaZero-based AI with dynamic difficulty adjustment (DDA). AlphaDDA consists of a deep neural network (DNN) and a Monte Carlo tree search, as in AlphaZero. AlphaDDA learns and plays a game the same way as AlphaZero, but can change its skills. AlphaDDA estimates the value of the game state from only the board state using the DNN. AlphaDDA changes a parameter dominantly controlling its skills according to the estimated value. Consequently, AlphaDDA adjusts its skills according to a game state. AlphaDDA can adjust its skill using only the state of a game without any prior knowledge regarding an opponent. In this study, AlphaDDA plays Connect4, Othello, and 6x6 Othello with other AI agents. Other AI agents are AlphaZero, Monte Carlo tree search, the minimax algorithm, and a random player. This study shows that AlphaDDA can balance its skill with that of the other AI agents, except for a random player. The DDA ability of AlphaDDA is based on an accurate estimation of the value from the state of a game. We believe that the AlphaDDA approach for DDA can be used for any game AI system if the DNN can accurately estimate the value of the game state and we know a parameter controlling the skills of the AI system.  ( 3 min )

Artificial intelligence (AI) has the potential to greatly improve society, but as with any powerful technology, it comes with heightened risks and responsibilities. Current AI research lacks a systematic discussion of how to manage long-tail risks from AI systems, including speculative long-term risks. Keeping in mind the potential benefits of AI, there is some concern that building ever more intelligent and powerful AI systems could eventually result in systems that are more powerful than us; some say this is like playing with fire and speculate that this could create existential risks (x-risks). To add precision and ground these discussions, we provide a guide for how to analyze AI x-risk, which consists of three parts: First, we review how systems can be made safer today, drawing on time-tested concepts from hazard analysis and systems safety that have been designed to steer large processes in safer directions. Next, we discuss strategies for having long-term impacts on the safety of future systems. Finally, we discuss a crucial concept in making AI systems safer by improving the balance between safety and general capabilities. We hope this document and the presented concepts and tools serve as a useful guide for understanding how to analyze AI x-risk.  ( 3 min )

Despite the extensive adoption of machine learning on the task of visual object tracking, recent learning-based approaches have largely overlooked the fact that visual tracking is a sequence-level task in its nature; they rely heavily on frame-level training, which inevitably induces inconsistency between training and testing in terms of both data distributions and task objectives. This work introduces a sequence-level training strategy for visual tracking based on reinforcement learning and discusses how a sequence-level design of data sampling, learning objectives, and data augmentation can improve the accuracy and robustness of tracking algorithms. Our experiments on standard benchmarks including LaSOT, TrackingNet, and GOT-10k demonstrate that four representative tracking models, SiamRPN++, SiamAttn, TransT, and TrDiMP, consistently improve by incorporating the proposed methods in training without modifying architectures.  ( 2 min )

Achieving realistic, vivid, and human-like synthesized conversational gestures conditioned on multi-modal data is still an unsolved problem due to the lack of available datasets, models and standard evaluation metrics. To address this, we build Body-Expression-Audio-Text dataset, BEAT, which has i) 76 hours, high-quality, multi-modal data captured from 30 speakers talking with eight different emotions and in four different languages, ii) 32 millions frame-level emotion and semantic relevance annotations. Our statistical analysis on BEAT demonstrates the correlation of conversational gestures with facial expressions, emotions, and semantics, in addition to the known correlation with audio, text, and speaker identity. Based on this observation, we propose a baseline model, Cascaded Motion Network (CaMN), which consists of above six modalities modeled in a cascaded architecture for gesture synthesis. To evaluate the semantic relevancy, we introduce a metric, Semantic Relevance Gesture Recall (SRGR). Qualitative and quantitative experiments demonstrate metrics' validness, ground truth data quality, and baseline's state-of-the-art performance. To the best of our knowledge, BEAT is the largest motion capture dataset for investigating human gestures, which may contribute to a number of different research fields, including controllable gesture synthesis, cross-modality analysis, and emotional gesture recognition. The data, code and model are available on https://pantomatrix.github.io/BEAT/.  ( 3 min )

Unsupervised Domain Adaptation demonstrates great potential to mitigate domain shifts by transferring models from labeled source domains to unlabeled target domains. While Unsupervised Domain Adaptation has been applied to a wide variety of complex vision tasks, only few works focus on lane detection for autonomous driving. This can be attributed to the lack of publicly available datasets. To facilitate research in these directions, we propose CARLANE, a 3-way sim-to-real domain adaptation benchmark for 2D lane detection. CARLANE encompasses the single-target datasets MoLane and TuLane and the multi-target dataset MuLane. These datasets are built from three different domains, which cover diverse scenes and contain a total of 163K unique images, 118K of which are annotated. In addition we evaluate and report systematic baselines, including our own method, which builds upon Prototypical Cross-domain Self-supervised Learning. We find that false positive and false negative rates of the evaluated domain adaptation methods are high compared to those of fully supervised baselines. This affirms the need for benchmarks such as CARLANE to further strengthen research in Unsupervised Domain Adaptation for lane detection. CARLANE, all evaluated models and the corresponding implementations are publicly available at https://carlanebenchmark.github.io.  ( 3 min )

Among attempts at giving a theoretical account of the success of deep neural networks, a recent line of work has identified a so-called `lazy' regime in which the network can be well approximated by its linearization around initialization. Here we investigate the comparative effect of the lazy (linear) and feature learning (non-linear) regimes on subgroups of examples based on their difficulty. Specifically, we show that easier examples are given more weight in feature learning mode, resulting in faster training compared to more difficult ones. In other words, the non-linear dynamics tends to sequentialize the learning of examples of increasing difficulty. We illustrate this phenomenon across different ways to quantify example difficulty, including c-score, label noise, and in the presence of spurious correlations. Our results reveal a new understanding of how deep networks prioritize resources across example difficulty.  ( 2 min )

We present Bayesian Team Imitation Learner (BTIL), an imitation learning algorithm to model the behavior of teams performing sequential tasks in Markovian domains. In contrast to existing multi-agent imitation learning techniques, BTIL explicitly models and infers the time-varying mental states of team members, thereby enabling learning of decentralized team policies from demonstrations of suboptimal teamwork. Further, to allow for sample- and label-efficient policy learning from small datasets, BTIL employs a Bayesian perspective and is capable of learning from semi-supervised demonstrations. We demonstrate and benchmark the performance of BTIL on synthetic multi-agent tasks as well as a novel dataset of human-agent teamwork. Our experiments show that BTIL can successfully learn team policies from demonstrations despite the influence of team members' (time-varying and potentially misaligned) mental states on their behavior.  ( 3 min )

This paper presents a method for learning logical task specifications and cost functions from demonstrations. Constructing specifications by hand is challenging for complex objectives and constraints in autonomous systems. Instead, we consider demonstrated task executions, whose logic structure and transition costs need to be inferred by an autonomous agent. We employ a spectral learning approach to extract a weighted finite automaton (WFA), approximating the unknown task logic. Thereafter, we define a product between the WFA for high-level task guidance and a labeled Markov decision process for low-level control. An inverse reinforcement learning (IRL) problem is considered to learn a cost function by backpropagating the loss between agent and expert behaviors through the planning algorithm. Our proposed model, termed WFA-IRL, is capable of generalizing the execution of the inferred task specification in a suite of MiniGrid environments.  ( 2 min )

We present a novel machine learning-based approach to solving bilevel programs that involve a large number of independent followers, which as a special case include two-stage stochastic programming. We propose an optimization model that explicitly considers a sampled subset of followers and exploits a machine learning model to estimate the objective values of unsampled followers. Unlike existing approaches, we embed machine learning model training into the optimization problem, which allows us to employ general follower features that can not be represented using leader decisions. We prove bounds on the optimality gap of the generated leader decision as measured by the original objective function that considers the full follower set. We then develop follower sampling algorithms to tighten the bounds and a representation learning approach to learn follower features, which can be used as inputs to the embedded machine learning model. Using synthetic instances of a cycling network design problem, we compare the computational performance of our approach versus baseline methods. Our approach provides more accurate predictions for follower objective values, and more importantly, generates leader decisions of higher quality. Finally, we perform a real-world case study on cycling infrastructure planning, where we apply our approach to solve a network design problem with over one million followers. Our approach presents favorable performance compared to the current cycling network expansion practices.  ( 3 min )

As safety violations can lead to severe consequences in real-world robotic applications, the increasing deployment of Reinforcement Learning (RL) in robotic domains has propelled the study of safe exploration for reinforcement learning (safe RL). In this work, we propose a risk preventive training method for safe RL, which learns a statistical contrastive classifier to predict the probability of a state-action pair leading to unsafe states. Based on the predicted risk probabilities, we can collect risk preventive trajectories and reshape the reward function with risk penalties to induce safe RL policies. We conduct experiments in robotic simulation environments. The results show the proposed approach has comparable performance with the state-of-the-art model-based methods and outperforms conventional model-free safe RL approaches.  ( 2 min )

Mean-Field Game (MFG) serves as a crucial mathematical framework in modeling the collective behavior of individual agents interacting stochastically with a large population. In this work, we aim at solving a challenging class of MFGs in which the differentiability of these interacting preferences may not be available to the solver, and the population is urged to converge exactly to some desired distribution. These setups are, despite being well-motivated for practical purposes, complicated enough to paralyze most (deep) numerical solvers. Nevertheless, we show that Schr\"odinger Bridge - as an entropy-regularized optimal transport model - can be generalized to accepting mean-field structures, hence solving these MFGs. This is achieved via the application of Forward-Backward Stochastic Differential Equations theory, which, intriguingly, leads to a computational framework with a similar structure to Temporal Difference learning. As such, it opens up novel algorithmic connections to Deep Reinforcement Learning that we leverage to facilitate practical training. We show that our proposed objective function provides necessary and sufficient conditions to the mean-field problem. Our method, named Deep Generalized Schr\"odinger Bridge (DeepGSB), not only outperforms prior methods in solving classical population navigation MFGs, but is also capable of solving 1000-dimensional opinion depolarization, setting a new state-of-the-art numerical solver for high-dimensional MFGs. Our code will be made available at https://github.com/ghliu/DeepGSB.  ( 2 min )

We present a new monotonic improvement guarantee for optimizing decentralized policies in cooperative Multi-Agent Reinforcement Learning (MARL), which holds even when the transition dynamics are non-stationary. This new analysis provides a theoretical understanding of the strong performance of two recent actor-critic methods for MARL, i.e., Independent Proximal Policy Optimization (IPPO) and Multi-Agent PPO (MAPPO), which both rely on independent ratios, i.e., computing probability ratios separately for each agent's policy. We show that, despite the non-stationarity that independent ratios cause, a monotonic improvement guarantee still arises as a result of enforcing the trust region constraint over all decentralized policies. We also show this trust region constraint can be effectively enforced in a principled way by bounding independent ratios based on the number of agents in training, providing a theoretical foundation for proximal ratio clipping. Moreover, we show that the surrogate objectives optimized in IPPO and MAPPO are essentially equivalent when their critics converge to a fixed point. Finally, our empirical results support the hypothesis that the strong performance of IPPO and MAPPO is a direct result of enforcing such a trust region constraint via clipping in centralized training, and the good values of the hyperparameters for this enforcement are highly sensitive to the number of agents, as predicted by our theoretical analysis.  ( 3 min )

The need for timely data analysis for economic decisions has prompted most economists and policy makers to search for non-traditional supplementary sources of data. In that context, text data is being explored to enrich traditional data sources because it is easy to collect and highly abundant. Our work focuses on studying the potential of textual data, in particular news pieces, for measuring economic policy uncertainty (EPU). Economic policy uncertainty is defined as the public's inability to predict the outcomes of their decisions under new policies and future economic fundamentals. Quantifying EPU is of great importance to policy makers, economists, and investors since it influences their expectations about the future economic fundamentals with an impact on their policy, investment and saving decisions. Most of the previous work using news articles for measuring EPU are either manual or based on a simple keyword search. Our work proposes a machine learning based solution involving weak supervision to classify news articles with regards to economic policy uncertainty. Weak supervision is shown to be an efficient machine learning paradigm for applying machine learning models in low resource settings with no or scarce training sets, leveraging domain knowledge and heuristics. We further generated a weak supervision based EPU index that we used to conduct extensive econometric analysis along with the Irish macroeconomic indicators to validate whether our generated index foreshadows weaker macroeconomic performance  ( 3 min )

Deep learning-based graph generation approaches have remarkable capacities for graph data modeling, allowing them to solve a wide range of real-world problems. Making these methods able to consider different conditions during the generation procedure even increases their effectiveness by empowering them to generate new graph samples that meet the desired criteria. This paper presents a conditional deep graph generation method called SCGG that considers a particular type of structural conditions. Specifically, our proposed SCGG model takes an initial subgraph and autoregressively generates new nodes and their corresponding edges on top of the given conditioning substructure. The architecture of SCGG consists of a graph representation learning network and an autoregressive generative model, which is trained end-to-end. Using this model, we can address graph completion, a rampant and inherently difficult problem of recovering missing nodes and their associated edges of partially observed graphs. Experimental results on both synthetic and real-world datasets demonstrate the superiority of our method compared with state-of-the-art baselines.  ( 2 min )

Batch processes show several sources of variability, from raw materials' properties to initial and evolving conditions that change during the different events in the manufacturing process. In this chapter, we will illustrate with an industrial example how to use machine learning to reduce this apparent excess of data while maintaining the relevant information for process engineers. Two common use cases will be presented: 1) AutoML analysis to quickly find correlations in batch process data, and 2) trajectory analysis to monitor and identify anomalous batches leading to process control improvements.  ( 2 min )

Physical systems whose dynamics are governed by partial differential equations (PDEs) find applications in numerous fields, from engineering design to weather forecasting. The process of obtaining the solution from such PDEs may be computationally expensive for large-scale and parameterized problems. In this work, deep learning techniques developed especially for time-series forecasts, such as LSTM and TCN, or for spatial-feature extraction such as CNN, are employed to model the system dynamics for advection dominated problems. These models take as input a sequence of high-fidelity vector solutions for consecutive time-steps obtained from the PDEs and forecast the solutions for the subsequent time-steps using auto-regression; thereby reducing the computation time and power needed to obtain such high-fidelity solutions. The models are tested on numerical benchmarks (1D Burgers' equation and Stoker's dam break problem) to assess the long-term prediction accuracy, even outside the training domain (extrapolation). Non-intrusive reduced-order modelling techniques such as deep auto-encoder networks are utilized to compress the high-fidelity snapshots before feeding them as input to the forecasting models in order to reduce the complexity and the required computations in the online and offline stages. Deep ensembles are employed to perform uncertainty quantification of the forecasting models, which provides information about the variance of the predictions as a result of the epistemic uncertainties.  ( 2 min )

Efficient global optimization is a widely used method for optimizing expensive black-box functions such as tuning hyperparameter, and designing new material, etc. Despite its popularity, less attention has been paid to analyzing the inherent hardness of the problem although, given its extensive use, it is important to understand the fundamental limits of efficient global optimization algorithms. In this paper, we study the worst-case complexity of the efficient global optimization problem and, in contrast to existing kernel-specific results, we derive a unified lower bound for the complexity of efficient global optimization in terms of the metric entropy of a ball in its corresponding reproducing kernel Hilbert space~(RKHS). Specifically, we show that if there exists a deterministic algorithm that achieves suboptimality gap smaller than $\epsilon$ for any function $f\in S$ in $T$ function evaluations, it is necessary that $T$ is at least $\Omega\left(\frac{\log\mathcal{N}(S(\mathcal{X}), 4\epsilon,\|\cdot\|_\infty)}{\log(\frac{R}{\epsilon})}\right)$, where $\mathcal{N}(\cdot,\cdot,\cdot)$ is the covering number, $S$ is the ball centered at $0$ with radius $R$ in the RKHS and $S(\mathcal{X})$ is the restriction of $S$ over the feasible set $\mathcal{X}$. Moreover, we show that this lower bound nearly matches the upper bound attained by non-adaptive search algorithms for the commonly used squared exponential kernel and the Mat\'ern kernel with a large smoothness parameter $\nu$, up to a replacement of $d/2$ by $d$ and a logarithmic term $\log\frac{R}{\epsilon}$. That is to say, our lower bound is nearly optimal for these kernels.  ( 3 min )

Ideological divisions in the United States have become increasingly prominent in daily communication. Accordingly, there has been much research on political polarization, including many recent efforts that take a computational perspective. By detecting political biases in a corpus of text, one can attempt to describe and discern the polarity of that text. Intuitively, the named entities (i.e., the nouns and phrases that act as nouns) and hashtags in text often carry information about political views. For example, people who use the term "pro-choice" are likely to be liberal, whereas people who use the term "pro-life" are likely to be conservative. In this paper, we seek to reveal political polarities in social-media text data and to quantify these polarities by explicitly assigning a polarity score to entities and hashtags. Although this idea is straightforward, it is difficult to perform such inference in a trustworthy quantitative way. Key challenges include the small number of known labels, the continuous spectrum of political views, and the preservation of both a polarity score and a polarity-neutral semantic meaning in an embedding vector of words. To attempt to overcome these challenges, we propose the Polarity-aware Embedding Multi-task learning (PEM) model. This model consists of (1) a self-supervised context-preservation task, (2) an attention-based tweet-level polarity-inference task, and (3) an adversarial learning task that promotes independence between an embedding's polarity dimension and its semantic dimensions. Our experimental results demonstrate that our PEM model can successfully learn polarity-aware embeddings. We examine a variety of applications and we thereby demonstrate the effectiveness of our PEM model. We also discuss important limitations of our work and stress caution when applying the PEM model to real-world scenarios.  ( 3 min )

Equilibrium Propagation (EP) is a powerful and more bio-plausible alternative to conventional learning frameworks such as backpropagation. The effectiveness of EP stems from the fact that it relies only on local computations and requires solely one kind of computational unit during both of its training phases, thereby enabling greater applicability in domains such as bio-inspired neuromorphic computing. The dynamics of the model in EP is governed by an energy function and the internal states of the model consequently converge to a steady state following the state transition rules defined by the same. However, by definition, EP requires the input to the model (a convergent RNN) to be static in both the phases of training. Thus it is not possible to design a model for sequence classification using EP with an LSTM or GRU like architecture. In this paper, we leverage recent developments in modern hopfield networks to further understand energy based models and develop solutions for complex sequence classification tasks using EP while satisfying its convergence criteria and maintaining its theoretical similarities with recurrent backpropagation. We explore the possibility of integrating modern hopfield networks as an attention mechanism with convergent RNN models used in EP, thereby extending its applicability for the first time on two different sequence classification tasks in natural language processing viz. sentiment analysis (IMDB dataset) and natural language inference (SNLI dataset).  ( 2 min )

The success of Reinforcement Learning (RL) heavily relies on the ability to learn robust representations from the observations of the environment. In most cases, the representations learned purely by the reinforcement learning loss can differ vastly across states depending on how the value functions change. However, the representations learned need not be very specific to the task at hand. Relying only on the RL objective may yield representations that vary greatly across successive time steps. In addition, since the RL loss has a changing target, the representations learned would depend on how good the current values/policies are. Thus, disentangling the representations from the main task would allow them to focus more on capturing transition dynamics which can improve generalization. To this end, we propose locally constrained representations, where an auxiliary loss forces the state representations to be predictable by the representations of the neighbouring states. This encourages the representations to be driven not only by the value/policy learning but also self-supervised learning, which constrains the representations from changing too rapidly. We evaluate the proposed method on several known benchmarks and observe strong performance. Especially in continuous control tasks, our experiments show a significant advantage over a strong baseline.  ( 2 min )

The rapid growth and deployment of deep learning (DL) has witnessed emerging privacy and security concerns. To mitigate these issues, secure multi-party computation (MPC) has been discussed, to enable the privacy-preserving DL computation. In practice, they often come at very high computation and communication overhead, and potentially prohibit their popularity in large scale systems. Two orthogonal research trends have attracted enormous interests in addressing the energy efficiency in secure deep learning, i.e., overhead reduction of MPC comparison protocol, and hardware acceleration. However, they either achieve a low reduction ratio and suffer from high latency due to limited computation and communication saving, or are power-hungry as existing works mainly focus on general computing platforms such as CPUs and GPUs. In this work, as the first attempt, we develop a systematic framework, PolyMPCNet, of joint overhead reduction of MPC comparison protocol and hardware acceleration, by integrating hardware latency of the cryptographic building block into the DNN loss function to achieve high energy efficiency, accuracy, and security guarantee. Instead of heuristically checking the model sensitivity after a DNN is well-trained (through deleting or dropping some non-polynomial operators), our key design principle is to em enforce exactly what is assumed in the DNN design -- training a DNN that is both hardware efficient and secure, while escaping the local minima and saddle points and maintaining high accuracy. More specifically, we propose a straight through polynomial activation initialization method for cryptographic hardware friendly trainable polynomial activation function to replace the expensive 2P-ReLU operator. We develop a cryptographic hardware scheduler and the corresponding performance model for Field Programmable Gate Arrays (FPGA) platform.  ( 3 min )

In this paper we study the practicality and usefulness of incorporating distributed representations of graphs into models within the context of drug pair scoring. We argue that the real world growth and update cycles of drug pair scoring datasets subvert the limitations of transductive learning associated with distributed representations. Furthermore, we argue that the vocabulary of discrete substructure patterns induced over drug sets is not dramatically large due to the limited set of atom types and constraints on bonding patterns enforced by chemistry. Under this pretext, we explore the effectiveness of distributed representations of the molecular graphs of drugs in drug pair scoring tasks such as drug synergy, polypharmacy, and drug-drug interaction prediction. To achieve this, we present a methodology for learning and incorporating distributed representations of graphs within a unified framework for drug pair scoring. Subsequently, we augment a number of recent and state-of-the-art models to utilise our embeddings. We empirically show that the incorporation of these embeddings improves downstream performance of almost every model across different drug pair scoring tasks, even those the original model was not designed for. We publicly release all of our drug embeddings for the DrugCombDB, DrugComb, DrugbankDDI, and TwoSides datasets.  ( 2 min )

The success of Transformer models has pushed the deep learning model scale to billions of parameters. Due to the limited memory resource of a single GPU, However, the best practice for choosing the optimal parallel strategy is still lacking, since it requires domain expertise in both deep learning and parallel computing. The Colossal-AI system addressed the above challenge by introducing a unified interface to scale your sequential code of model training to distributed environments. It supports parallel training methods such as data, pipeline, tensor, and sequence parallelism, as well as heterogeneous training methods integrated with zero redundancy optimizer. Compared to the baseline system, Colossal-AI can achieve up to 2.76 times training speedup on large-scale models.  ( 2 min )

Purpose- Coarctation of the Aorta (CoA) patient-specific computational fluid dynamics (CFD) studies in resource constrained settings are limited by the available imaging modalities for geometry and velocity data acquisition. Doppler echocardiography has been seen as a suitable velocity acquisition modality due to its higher availability and safety. This study aimed to investigate the application of classical machine learning (ML) methods to create an adequate and robust approach for obtaining boundary conditions (BCs) from Doppler Echocardiography images, for haemodynamic modeling using CFD. Methods- Our proposed approach combines ML and CFD to model haemodynamic flow within the region of interest. With the key feature of the approach being the use of ML models to calibrate the inlet and outlet boundary conditions (BCs) of the CFD model. The key input variable for the ML model was the patients heart rate as this was the parameter that varied in time across the measured vessels within the study. ANSYS Fluent was used for the CFD component of the study whilst the scikit-learn python library was used for the ML component. Results- We validated our approach against a real clinical case of severe CoA before intervention. The maximum coarctation velocity of our simulations were compared to the measured maximum coarctation velocity obtained from the patient whose geometry is used within the study. Of the 5 ML models used to obtain BCs the top model was within 5\% of the measured maximum coarctation velocity. Conclusion- The framework demonstrated that it was capable of taking variations of the patients heart rate between measurements into account. Thus, enabling the calculation of BCs that were physiologically realistic when the heart rate was scaled across each vessel whilst providing a reasonably accurate solution.  ( 3 min )

Semantic communication in the 6G era has been deemed a promising communication paradigm to break through the bottleneck of traditional communications. However, its applications for the multi-user scenario, especially the broadcasting case, remain under-explored. To effectively exploit the benefits enabled by semantic communication, in this paper, we propose a one-to-many semantic communication system. Specifically, we propose a deep neural network (DNN) enabled semantic communication system called MR\_DeepSC. By leveraging semantic features for different users, a semantic recognizer based on the pre-trained model, i.e., DistilBERT, is built to distinguish different users. Furthermore, the transfer learning is adopted to speed up the training of new receiver networks. Simulation results demonstrate that the proposed MR\_DeepSC can achieve the best performance in terms of BLEU score than the other benchmarks under different channel conditions, especially in the low signal-to-noise ratio (SNR) regime.  ( 2 min )

In this paper, we consider the computational complexity of bounding the reachable set of a Linear Time-Invariant (LTI) system controlled by a Rectified Linear Unit (ReLU) Two-Level Lattice (TLL) Neural Network (NN) controller. In particular, we show that for such a system and controller, it is possible to compute the exact one-step reachable set in polynomial time in the size of the size of the TLL NN controller (number of neurons). Additionally, we show that it is possible to obtain a tight bounding box of the reachable set via two polynomial-time methods: one with polynomial complexity in the size of the TLL and the other with polynomial complexity in the Lipschitz constant of the controller and other problem parameters. Crucially, the smaller of the two can be decided in polynomial time for non-degenerate TLL NNs. Finally, we propose a pragmatic algorithm that adaptively combines the benefits of (semi-)exact reachability and approximate reachability, which we call L-TLLBox. We evaluate L-TLLBox with an empirical comparison to a state-of-the-art NN controller reachability tool. In these experiments, L-TLLBox was able to complete reachability analysis as much as 5000x faster than this tool on the same network/system, while producing reach boxes that were from 0.08 to 1.42 times the area.  ( 3 min )

Robustness to distribution shift and fairness have independently emerged as two important desiderata required of modern machine learning models. While these two desiderata seem related, the connection between them is often unclear in practice. Here, we discuss these connections through a causal lens, focusing on anti-causal prediction tasks, where the input to a classifier (e.g., an image) is assumed to be generated as a function of the target label and the protected attribute. By taking this perspective, we draw explicit connections between a common fairness criterion - separation - and a common notion of robustness - risk invariance. These connections provide new motivation for applying the separation criterion in anticausal settings, and inform old discussions regarding fairness-performance tradeoffs. In addition, our findings suggest that robustness-motivated approaches can be used to enforce separation, and that they often work better in practice than methods designed to directly enforce separation. Using a medical dataset, we empirically validate our findings on the task of detecting pneumonia from X-rays, in a setting where differences in prevalence across sex groups motivates a fairness mitigation. Our findings highlight the importance of considering causal structure when choosing and enforcing fairness criteria.  ( 2 min )

Inspired by humans' remarkable ability to master arithmetic and generalize to unseen problems, we present a new dataset, HINT, to study machines' capability of learning generalizable concepts at three levels: perception, syntax, and semantics. Learning agents are tasked to reckon how concepts are perceived from raw signals such as images (i.e., perception), how multiple concepts are structurally combined to form a valid expression (i.e., syntax), and how concepts are realized to afford various reasoning tasks (i.e., semantics), all in a weakly supervised manner. With a focus on systematic generalization, we carefully design a five-fold test set to evaluate both the interpolation and the extrapolation of learned concepts w.r.t. the three levels. We further design a few-shot learning split to test whether models could quickly learn new concepts and generalize them to more complex scenarios. To understand existing models' limitations, we conduct extensive experiments with various sequence-to-sequence models, including RNNs, Transformers, and GPT-3 (with the chain of thought prompting). The results suggest that current models still struggle in extrapolation to long-range syntactic dependency and semantics. Models show a significant gap toward human-level generalization when tested with new concepts in a few-shot setting. Moreover, we find that it is infeasible to solve HINT by simply scaling up the dataset and the model size; this strategy barely helps the extrapolation over syntax and semantics. Finally, in zero-shot GPT-3 experiments, the chain of thought prompting shows impressive results and significantly boosts the test accuracy. We believe the proposed dataset together with the experimental findings is of great interest to the community on systematic generalization.  ( 3 min )

Extreme events in society and nature, such as pandemic spikes, rogue waves, or structural failures, can have catastrophic consequences. Characterizing extremes is difficult as they occur rarely, arise from seemingly benign conditions, and belong to complex and often unknown infinite-dimensional systems. Such challenges render attempts at characterizing them as moot. We address each of these difficulties by combining novel training schemes in Bayesian experimental design (BED) with an ensemble of deep neural operators (DNOs). This model-agnostic framework pairs a BED scheme that actively selects data for quantifying extreme events with an ensemble of DNOs that approximate infinite-dimensional nonlinear operators. We find that not only does this framework clearly beat Gaussian processes (GPs) but that 1) shallow ensembles of just two members perform best; 2) extremes are uncovered regardless of the state of initial data (i.e. with or without extremes); 3) our method eliminates "double-descent" phenomena; 4) the use of batches of suboptimal acquisition points compared to step-by-step global optima does not hinder BED performance; and 5) Monte Carlo acquisition outperforms standard optimizers in high-dimensions. Together these conclusions form the foundation of an AI-assisted experimental infrastructure that can efficiently infer and pinpoint critical situations across many domains, from physical to societal systems.  ( 3 min )

In video compression, coding efficiency is improved by reusing pixels from previously decoded frames via motion and residual compensation. We define two levels of hierarchical redundancy in video frames: 1) first-order: redundancy in pixel space, i.e., similarities in pixel values across neighboring frames, which is effectively captured using motion and residual compensation, 2) second-order: redundancy in motion and residual maps due to smooth motion in natural videos. While most of the existing neural video coding literature addresses first-order redundancy, we tackle the problem of capturing second-order redundancy in neural video codecs via predictors. We introduce generic motion and residual predictors that learn to extrapolate from previously decoded data. These predictors are lightweight, and can be employed with most neural video codecs in order to improve their rate-distortion performance. Moreover, while RGB is the dominant colorspace in neural video coding literature, we introduce general modifications for neural video codecs to embrace the YUV420 colorspace and report YUV420 results. Our experiments show that using our predictors with a well-known neural video codec leads to 38% and 34% bitrate savings in RGB and YUV420 colorspaces measured on the UVG dataset.  ( 3 min )

Clinical records frequently include assessments of the characteristics of patients, which may include the completion of various questionnaires. These questionnaires provide a variety of perspectives on a patient's current state of well-being. Not only is it critical to capture the heterogeneity given by these perspectives, but there is also a growing demand for developing cost-effective technologies for clinical phenotyping. Filling out many questionnaires may be a strain for the patients and therefore costly. In this work, we propose COBALT -- a cost-based layer selector model for detecting phenotypes using a community detection approach. Our goal is to minimize the number of features used to build these phenotypes while preserving its quality. We test our model using questionnaire data from chronic tinnitus patients and represent the data in a multi-layer network structure. The model is then evaluated by predicting post-treatment data using baseline features (age, gender, and pre-treatment data) as well as the identified phenotypes as a feature. For some post-treatment variables, predictors using phenotypes from COBALT as features outperformed those using phenotypes detected by traditional clustering methods. Moreover, using phenotype data to predict post-treatment data proved beneficial in comparison with predictors that were solely trained with baseline features.  ( 3 min )

Reconfigurable intelligent surface (RIS) can significantly enhance the service coverage of Tera-Hertz massive multiple-input multiple-output (MIMO) communication systems. However, obtaining accurate high-dimensional channel state information (CSI) with limited pilot and feedback signaling overhead is challenging, severely degrading the performance of conventional spatial division multiple access. To improve the robustness against CSI imperfection, this paper proposes a deep learning (DL)-based rate-splitting multiple access (RSMA) scheme for RIS-aided Tera-Hertz multi-user MIMO systems. Specifically, we first propose a hybrid data-model driven DL-based RSMA precoding scheme, including the passive precoding at the RIS as well as the analog active precoding and the RSMA digital active precoding at the base station (BS). To realize the passive precoding at the RIS, we propose a Transformer-based data-driven RIS reflecting network (RRN). As for the analog active precoding at the BS, we propose a match-filter based analog precoding scheme considering that the BS and RIS adopt the LoS-MIMO antenna array architecture. As for the RSMA digital active precoding at the BS, we propose a low-complexity approximate weighted minimum mean square error (AWMMSE) digital precoding scheme. Furthermore, for better precoding performance as well as lower computational complexity, a model-driven deep unfolding active precoding network (DFAPN) is also designed by combining the proposed AWMMSE scheme with DL. Then, to acquire accurate CSI at the BS for the investigated RSMA precoding scheme to achieve higher spectral efficiency, we propose a CSI acquisition network (CAN) with low pilot and feedback signaling overhead, where the downlink pilot transmission, CSI feedback at the user equipments (UEs), and CSI reconstruction at the BS are modeled as an end-to-end neural network based on Transformer.  ( 3 min )

Hyperdimensional computing (HDC) is a paradigm for data representation and learning originating in computational neuroscience. HDC represents data as high-dimensional, low-precision vectors which can be used for a variety of information processing tasks like learning or recall. The mapping to high-dimensional space is a fundamental problem in HDC, and existing methods encounter scalability issues when the input data itself is high-dimensional. In this work, we explore a family of streaming encoding techniques based on hashing. We show formally that these methods enjoy comparable guarantees on performance for learning applications while being substantially more efficient than existing alternatives. We validate these results experimentally on a popular high-dimensional classification problem and show that our approach easily scales to very large data sets.  ( 2 min )

In recent years, machine learning has been widely adopted to automate the audio mixing process. Automatic mixing systems have been applied to various audio effects such as gain-adjustment, equalization, and reverberation. These systems can be controlled through visual interfaces, providing audio examples, using knobs, and semantic descriptors. Using semantic descriptors or textual information to control these systems is an effective way for artists to communicate their creative goals. In this paper, we explore the novel idea of using word embeddings to represent semantic descriptors. Word embeddings are generally obtained by training neural networks on large corpora of written text. These embeddings serve as the input layer of the neural network to create a translation from words to EQ settings. Using this technique, the machine learning model can also generate EQ settings for semantic descriptors that it has not seen before. We compare the EQ settings of humans with the predictions of the neural network to evaluate the quality of predictions. The results showed that the embedding layer enables the neural network to understand semantic descriptors. We observed that the models with embedding layers perform better than those without embedding layers, but still not as good as human labels.  ( 3 min )

In this work, the integration of two machine learning approaches, namely domain adaptation and explainable AI, is proposed to address these two issues of generalized detection and explainability. Firstly the Domain Adversarial Neural Network (DANN) develops a generalized misinformation detector across multiple social media platforms DANN is employed to generate the classification results for test domains with relevant but unseen data. The DANN-based model, a traditional black-box model, cannot justify its outcome, i.e., the labels for the target domain. Hence a Local Interpretable Model-Agnostic Explanations (LIME) explainable AI model is applied to explain the outcome of the DANN mode. To demonstrate these two approaches and their integration for effective explainable generalized detection, COVID-19 misinformation is considered a case study. We experimented with two datasets, namely CoAID and MiSoVac, and compared results with and without DANN implementation. DANN significantly improves the accuracy measure F1 classification score and increases the accuracy and AUC performance. The results obtained show that the proposed framework performs well in the case of domain shift and can learn domain-invariant features while explaining the target labels with LIME implementation enabling trustworthy information processing and extraction to combat misinformation effectively.  ( 3 min )

Weight norm $\|w\|$ and margin $\gamma$ participate in learning theory via the normalized margin $\gamma/\|w\|$. Since standard neural net optimizers do not control normalized margin, it is hard to test whether this quantity causally relates to generalization. This paper designs a series of experimental studies that explicitly control normalized margin and thereby tackle two central questions. First: does normalized margin always have a causal effect on generalization? The paper finds that no -- networks can be produced where normalized margin has seemingly no relationship with generalization, counter to the theory of Bartlett et al. (2017). Second: does normalized margin ever have a causal effect on generalization? The paper finds that yes -- in a standard training setup, test performance closely tracks normalized margin. The paper suggests a Gaussian process model as a promising explanation for this behavior.  ( 2 min )

The ability to detect Out-of-Distribution (OOD) data is important in safety-critical applications of deep learning. The aim is to separate In-Distribution (ID) data drawn from the training distribution from OOD data using a measure of uncertainty extracted from a deep neural network. Deep Ensembles are a well-established method of improving the quality of uncertainty estimates produced by deep neural networks, and have been shown to have superior OOD detection performance compared to single models. An existing intuition in the literature is that the diversity of Deep Ensemble predictions indicates distributional shift, and so measures of diversity such as Mutual Information (MI) should be used for OOD detection. We show experimentally that this intuition is not valid on ImageNet-scale OOD detection -- using MI leads to 30-40% worse %FPR@95 compared to single-model entropy on some OOD datasets. We suggest an alternative explanation for Deep Ensembles' better OOD detection performance -- OOD detection is binary classification and we are ensembling diverse classifiers. As such we show that practically, even better OOD detection performance can be achieved for Deep Ensembles by averaging task-specific detection scores such as Energy over the ensemble.  ( 3 min )

In many web applications, deep learning-based CTR prediction models (deep CTR models for short) are widely adopted. Traditional deep CTR models learn patterns in a static manner, i.e., the network parameters are the same across all the instances. However, such a manner can hardly characterize each of the instances which may have different underlying distributions. It actually limits the representation power of deep CTR models, leading to sub-optimal results. In this paper, we propose an efficient, effective, and universal module, named as Adaptive Parameter Generation network (APG), which can dynamically generate parameters for deep CTR models on-the-fly based on different instances. Extensive experimental evaluation results show that APG can be applied to a variety of deep CTR models and significantly improve their performance. Meanwhile, APG can reduce the time cost by 38.7\% and memory usage by 96.6\% compared to a regular deep CTR model. We have deployed APG in the industrial sponsored search system and achieved 3\% CTR gain and 1\% RPM gain respectively.  ( 2 min )

DADApy is a python software package for analysing and characterising high-dimensional data manifolds. It provides methods for estimating the intrinsic dimension and the probability density, for performing density-based clustering and for comparing different distance metrics. We review the main functionalities of the package and exemplify its usage in toy cases and in a real-world application. DADApy is freely available under the open-source Apache 2.0 license.  ( 2 min )

Forecasting time series data represents an emerging field of research in data science and knowledge discovery with vast applications ranging from stock price and energy demand prediction to the early prediction of epidemics. Numerous statistical and machine learning methods have been proposed in the last five decades with the demand for high-quality and reliable forecasts. However, in real-life prediction problems, situations exist in which a model based on one of the above paradigms is preferable. Therefore, hybrid solutions are needed to bridge the gap between classical forecasting methods and modern neural network models. In this context, we introduce a Probabilistic AutoRegressive Neural Network (PARNN) model that can handle a wide variety of complex time series data (e.g., nonlinearity, non-seasonal, long-range dependence, and non-stationarity). The proposed PARNN model is built by creating a fusion of an integrated moving average and autoregressive neural network to preserve the explainability, scalability, and ``white-box-like'' prediction behavior of the individuals. Sufficient conditions for asymptotic stationarity and geometric ergodicity are obtained by considering the asymptotic behavior of the associated Markov chain. Unlike advanced deep learning tools, the uncertainty quantification of the PARNN model based on prediction intervals is obtained. During computational experiments, PARNN outperforms standard statistical, machine learning, and deep learning models (e.g., Transformers, NBeats, DeepAR, etc.) on a diverse collection of real-world datasets from macroeconomics, tourism, energy, epidemiology, and others for short-term, medium-term, and long-term forecasting. Multiple comparisons with the best method are carried out to showcase the superiority of the proposal in comparison with the state-of-the-art forecasters over different forecast horizons.  ( 3 min )

Recent work in black-box adversarial attacks for NLP systems has attracted much attention. Prior black-box attacks assume that attackers can observe output labels from target models based on selected inputs. In this work, inspired by adversarial transferability, we propose a new type of black-box NLP adversarial attack that an attacker can choose a similar domain and transfer the adversarial examples to the target domain and cause poor performance in target model. Based on domain adaptation theory, we then propose a defensive strategy, called Learn2Weight, which trains to predict the weight adjustments for a target model in order to defend against an attack of similar-domain adversarial examples. Using Amazon multi-domain sentiment classification datasets, we empirically show that Learn2Weight is effective against the attack compared to standard black-box defense methods such as adversarial training and defensive distillation. This work contributes to the growing literature on machine learning safety.  ( 2 min )

This paper is concerned with the training of neural networks (NNs) under semidefinite constraints, which allows for NN training with robustness and stability guarantees. In particular, we focus on Lipschitz bounds for NNs. Exploiting the banded structure of the underlying matrix constraint, we set up an efficient and scalable training scheme for NN training problems of this kind based on interior point methods. Our implementation allows to enforce Lipschitz constraints in the training of large-scale deep NNs such as Wasserstein generative adversarial networks (WGANs) via semidefinite constraints. In numerical examples, we show the superiority of our method and its applicability to WGAN training.  ( 2 min )

World models learn the consequences of actions in vision-based interactive systems. However, in practical scenarios such as autonomous driving, there commonly exists noncontrollable dynamics independent of the action signals, making it difficult to learn effective world models. To tackle this problem, we present a novel reinforcement learning approach named Iso-Dream, which improves the Dream-to-Control framework in two aspects. First, by optimizing the inverse dynamics, we encourage the world model to learn controllable and noncontrollable sources of spatiotemporal changes on isolated state transition branches. Second, we optimize the behavior of the agent on the decoupled latent imaginations of the world model. Specifically, to estimate state values, we roll-out the noncontrollable states into the future and associate them with the current controllable state. In this way, the isolation of dynamics sources can greatly benefit long-horizon decision-making of the agent, such as a self-driving car that can avoid potential risks by anticipating the movement of other vehicles. Experiments show that Iso-Dream is effective in decoupling the mixed dynamics and remarkably outperforms existing approaches in a wide range of visual control and prediction domains.  ( 2 min )

Recent exploration of the multi-agent backdoor attack demonstrated the backfiring effect, a natural defense against backdoor attacks where backdoored inputs are randomly classified. This yields a side-effect of low accuracy w.r.t. clean labels, which motivates this paper's work on the construction of multi-agent backdoor defenses that maximize accuracy w.r.t. clean labels and minimize that of poison labels. Founded upon agent dynamics and low-loss subspace construction, we contribute three defenses that yield improved multi-agent backdoor robustness.  ( 2 min )

Image generative models can learn the distributions of the training data and consequently generate examples by sampling from these distributions. However, when the training dataset is corrupted with outliers, generative models will likely produce examples that are also similar to the outliers. In fact, a small portion of outliers may induce state-of-the-art generative models, such as Vector Quantized-Variational AutoEncoder (VQ-VAE), to learn a significant mode from the outliers. To mitigate this problem, we propose a robust generative model based on VQ-VAE, which we name Robust VQ-VAE (RVQ-VAE). In order to achieve robustness, RVQ-VAE uses two separate codebooks for the inliers and outliers. To ensure the codebooks embed the correct components, we iteratively update the sets of inliers and outliers during each training epoch. To ensure that the encoded data points are matched to the correct codebooks, we quantize using a weighted Euclidean distance, whose weights are determined by directional variances of the codebooks. Both codebooks, together with the encoder and decoder, are trained jointly according to the reconstruction loss and the quantization loss. We experimentally demonstrate that RVQ-VAE is able to generate examples from inliers even if a large portion of the training data points are corrupted.  ( 3 min )

Random convolution kernel transform (Rocket) is a fast, efficient, and novel approach for time series feature extraction using a large number of independent randomly initialized 1-D convolution kernels of different configurations. The output of the convolution operation on each time series is represented by a partial positive value (PPV). A concatenation of PPVs from all kernels is the input feature vector to a Ridge regression classifier. Unlike typical deep learning models, the kernels are not trained and there is no weighted/trainable connection between kernels or concatenated features and the classifier. Since these kernels are generated randomly, a portion of these kernels may not positively contribute in performance of the model. Hence, selection of the most important kernels and pruning the redundant and less important ones is necessary to reduce computational complexity and accelerate inference of Rocket for applications on the edge devices. Selection of these kernels is a combinatorial optimization problem. In this paper, we propose a scheme for selecting these kernels while maintaining the classification performance. First, the original model is pre-trained at full capacity. Then, a population of binary candidate state vectors is initialized where each element of a vector represents the active/inactive status of a kernel. A population-based optimization algorithm evolves the population in order to find a best state vector which minimizes the number of active kernels while maximizing the accuracy of the classifier. This activation function is a linear combination of the total number of active kernels and the classification accuracy of the pre-trained classifier with the active kernels. Finally, the selected kernels in the best state vector are utilized to train the Ridge regression classifier with the selected kernels.  ( 3 min )

In standard neural network training, the gradients in the backward pass are determined by the forward pass. As a result, the two stages are coupled. This is how most neural networks are trained currently. However, gradient modification in the backward pass has seldom been studied in the literature. In this paper we explore decoupled training, where we alter the gradients in the backward pass. We propose a simple yet powerful method called PowerGrad Transform, that alters the gradients before the weight update in the backward pass and significantly enhances the predictive performance of the neural network. PowerGrad Transform trains the network to arrive at a better optima at convergence. It is computationally extremely efficient, virtually adding no additional cost to either memory or compute, but results in improved final accuracies on both the training and test sets. PowerGrad Transform is easy to integrate into existing training routines, requiring just a few lines of code. PowerGrad Transform accelerates training and makes it possible for the network to better fit the training data. With decoupled training, PowerGrad Transform improves baseline accuracies for ResNet-50 by 0.73%, for SE-ResNet-50 by 0.66% and by more than 1.0% for the non-normalized ResNet-18 network on the ImageNet classification task.  ( 3 min )

We consider the well-studied problem of decomposing a vector time series signal into components with different characteristics, such as smooth, periodic, nonnegative, or sparse. We describe a simple and general framework in which the components are defined by loss functions (which include constraints), and the signal decomposition is carried out by minimizing the sum of losses of the components (subject to the constraints). When each loss function is the negative log-likelihood of a density for the signal component, this framework coincides with maximum a posteriori probability (MAP) estimation; but it also includes many other interesting cases. Summarizing and clarifying prior results, we give two distributed optimization methods for computing the decomposition, which find the optimal decomposition when the component class loss functions are convex, and are good heuristics when they are not. Both methods require only the masked proximal operator of each of the component loss functions, a generalization of the well-known proximal operator that handles missing entries in its argument. Both methods are distributed, i.e., handle each component separately. We derive tractable methods for evaluating the masked proximal operators of some loss functions that, to our knowledge, have not appeared in the literature.  ( 3 min )

Identifying the heterogeneous conductivity field and reconstructing the contaminant release history are key aspects of subsurface remediation. Achieving these two goals with limited and noisy hydraulic head and concentration measurements is challenging. The obstacles include solving an inverse problem for high-dimensional parameters, and the high-computational cost needed for the repeated forward modeling. We use a convolutional adversarial autoencoder (CAAE) for the parameterization of the heterogeneous non-Gaussian conductivity field with a low-dimensional latent representation. Additionally, we trained a three-dimensional dense convolutional encoder-decoder (DenseED) network to serve as the forward surrogate for the flow and transport processes. Combining the CAAE and DenseED forward surrogate models, the ensemble smoother with multiple data assimilation (ESMDA) algorithm is used to sample from the Bayesian posterior distribution of the unknown parameters, forming a CAAE-DenseED-ESMDA inversion framework. We applied this CAAE-DenseED-ESMDA inversion framework in a three-dimensional contaminant source and conductivity field identification problem. A comparison of the inversion results from CAAE-ESMDA with physical flow and transport simulator and CAAE-DenseED-ESMDA is provided, showing that accurate reconstruction results were achieved with a much higher computational efficiency.  ( 3 min )

We present LINGUIST, a method for generating annotated data for Intent Classification and Slot Tagging (IC+ST), via fine-tuning AlexaTM 5B, a 5-billion-parameter multilingual sequence-to-sequence (seq2seq) model, on a flexible instruction prompt. In a 10-shot novel intent setting for the SNIPS dataset, LINGUIST surpasses state-of-the-art approaches (Back-Translation and Example Extrapolation) by a wide margin, showing absolute improvement for the target intents of +1.9 points on IC Recall and +2.5 points on ST F1 Score. In the zero-shot cross-lingual setting of the mATIS++ dataset, LINGUIST out-performs a strong baseline of Machine Translation with Slot Alignment by +4.14 points absolute on ST F1 Score across 6 languages, while matching performance on IC. Finally, we verify our results on an internal large-scale multilingual dataset for conversational agent IC+ST and show significant improvements over a baseline which uses Back-Translation, Paraphrasing and Slot Catalog Resampling. To our knowledge, we are the first to demonstrate instruction fine-tuning of a large-scale seq2seq model to control the outputs of multilingual intent- and slot-labeled data generation.  ( 2 min )

Benign overfitting, the phenomenon where interpolating models generalize well in the presence of noisy data, was first observed in neural network models trained with gradient descent. To better understand this empirical observation, we consider the generalization error of two-layer neural networks trained to interpolation by gradient descent on the logistic loss following random initialization. We assume the data comes from well-separated class-conditional log-concave distributions and allow for a constant fraction of the training labels to be corrupted by an adversary. We show that in this setting, neural networks exhibit benign overfitting: they can be driven to zero training error, perfectly fitting any noisy training labels, and simultaneously achieve minimax optimal test error. In contrast to previous work on benign overfitting that require linear or kernel-based predictors, our analysis holds in a setting where both the model and learning dynamics are fundamentally nonlinear.  ( 2 min )

Significant efforts are being invested to bring state-of-the-art classification and recognition to edge devices with extreme resource constraints (memory, speed, and lack of GPU support). Here, we demonstrate the first deep network for acoustic recognition that is small, flexible and compression-friendly yet achieves state-of-the-art performance for raw audio classification. Rather than handcrafting a once-off solution, we present a generic pipeline that automatically converts a large deep convolutional network via compression and quantization into a network for resource-impoverished edge devices. After introducing ACDNet, which produces above state-of-the-art accuracy on ESC-10 (96.65%), ESC-50 (87.10%), UrbanSound8K (84.45%) and AudioEvent (92.57%), we describe the compression pipeline and show that it allows us to achieve 97.22% size reduction and 97.28% FLOP reduction while maintaining close to state-of-the-art accuracy 96.25%, 83.65%, 78.27% and 89.69% on these datasets. We describe a successful implementation on a standard off-the-shelf microcontroller and, beyond laboratory benchmarks, report successful tests on real-world datasets.  ( 3 min )

Integrating knowledge across different domains is an essential feature of human learning. Learning paradigms such as transfer learning, meta learning, and multi-task learning reflect the human learning process by exploiting the prior knowledge for new tasks, encouraging faster learning and good generalization for new tasks. This article gives a detailed view of these learning paradigms and their comparative analysis. The weakness of one learning algorithm turns out to be a strength of another, and thus merging them is a prevalent trait in the literature. There are numerous research papers that focus on each of these learning paradigms separately and provide a comprehensive overview of them. However, this article provides a review of research studies that combine (two of) these learning algorithms. This survey describes how these techniques are combined to solve problems in many different fields of study, including computer vision, natural language processing, hyperspectral imaging, and many more. As a result, the global generic learning network an amalgamation of meta learning, transfer learning, and multi-task learning is introduced here, along with some open research questions and future research directions in the multi-task setting.  ( 3 min )

We study the problem of learning a Hamiltonian $H$ to precision $\varepsilon$, supposing we are given copies of its Gibbs state $\rho=\exp(-\beta H)/\operatorname{Tr}(\exp(-\beta H))$ at a known inverse temperature $\beta$. Anshu, Arunachalam, Kuwahara, and Soleimanifar (Nature Physics, 2021, arXiv:2004.07266) recently studied the sample complexity (number of copies of $\rho$ needed) of this problem for geometrically local $N$-qubit Hamiltonians. In the high-temperature (low $\beta$) regime, their algorithm has sample complexity poly$(N, 1/\beta,1/\varepsilon)$ and can be implemented with polynomial, but suboptimal, time complexity. In this paper, we study the same question for a more general class of Hamiltonians. We show how to learn the coefficients of a Hamiltonian to error $\varepsilon$ with sample complexity $S = O(\log N/(\beta\varepsilon)^{2})$ and time complexity linear in the sample size, $O(S N)$. Furthermore, we prove a matching lower bound showing that our algorithm's sample complexity is optimal, and hence our time complexity is also optimal. In the appendix, we show that virtually the same algorithm can be used to learn $H$ from a real-time evolution unitary $e^{-it H}$ in a small $t$ regime with similar sample and time complexity.  ( 3 min )

Deep reinforcement learning (RL) has led to many recent and groundbreaking advances. However, these advances have often come at the cost of both increased scale in the underlying architectures being trained as well as increased complexity of the RL algorithms used to train them. These increases have in turn made it more difficult for researchers to rapidly prototype new ideas or reproduce published RL algorithms. To address these concerns this work describes Acme, a framework for constructing novel RL algorithms that is specifically designed to enable agents that are built using simple, modular components that can be used at various scales of execution. While the primary goal of Acme is to provide a framework for algorithm development, a secondary goal is to provide simple reference implementations of important or state-of-the-art algorithms. These implementations serve both as a validation of our design decisions as well as an important contribution to reproducibility in RL research. In this work we describe the major design decisions made within Acme and give further details as to how its components can be used to implement various algorithms. Our experiments provide baselines for a number of common and state-of-the-art algorithms as well as showing how these algorithms can be scaled up for much larger and more complex environments. This highlights one of the primary advantages of Acme, namely that it can be used to implement large, distributed RL algorithms that can run at massive scales while still maintaining the inherent readability of that implementation. This work presents a second version of the paper which coincides with an increase in modularity, additional emphasis on offline, imitation and learning from demonstrations algorithms, as well as various new agents implemented as part of Acme.  ( 3 min )

The travel time data collected from widespread traffic monitoring sensors necessitate big data analytic tools for querying, visualization, and identifying meaningful traffic patterns. This paper utilizes a large-scale travel time dataset from Caltrans Performance Measurement System (PeMS) system that is an overflow for traditional data processing and modeling tools. To overcome the challenges of the massive amount of data, the big data analytic engines Apache Spark and Apache MXNet are applied for data wrangling and modeling. Seasonality and autocorrelation were performed to explore and visualize the trend of time-varying data. Inspired by the success of the hierarchical architecture for many Artificial Intelligent (AI) tasks, we consolidate the cell and hidden states passed from low-level to the high-level LSTM with an attention pooling similar to how the human perception system operates. The designed hierarchical LSTM model can consider the dependencies at different time scales to capture the spatial-temporal correlations of network-level travel time. Another self-attention module is then devised to connect LSTM extracted features to the fully connected layers, predicting travel time for all corridors instead of a single link/route. The comparison results show that the Hierarchical LSTM with Attention (HierLSTMat) model gives the best prediction results at 30-minute and 45-min horizons and can successfully forecast unusual congestion. The efficiency gained from big data analytic tools was evaluated by comparing them with popular data science and deep learning frameworks.  ( 3 min )

Motivated by the fragility of neural network (NN) controllers in safety-critical applications, we present a data-driven framework for verifying the risk of stochastic dynamical systems with NN controllers. Given a stochastic control system, an NN controller, and a specification equipped with a notion of trace robustness (e.g., constraint functions or signal temporal logic), we collect trajectories from the system that may or may not satisfy the specification. In particular, each of the trajectories produces a robustness value that indicates how well (severely) the specification is satisfied (violated). We then compute risk metrics over these robustness values to estimate the risk that the NN controller will not satisfy the specification. We are further interested in quantifying the difference in risk between two systems, and we show how the risk estimated from a nominal system can provide an upper bound the risk of a perturbed version of the system. In particular, the tightness of this bound depends on the closeness of the systems in terms of the closeness of their system trajectories. For Lipschitz continuous and incrementally input-to-state stable systems, we show how to exactly quantify system closeness with varying degrees of conservatism, while we estimate system closeness for more general systems from data in our experiments. We demonstrate our risk verification approach on two case studies, an underwater vehicle and an F1/10 autonomous car.  ( 3 min )

Partial differential equations are often used to model various physical phenomena, such as heat diffusion, wave propagation, fluid dynamics, elasticity, electrodynamics and image processing, and many analytic approaches or traditional numerical methods have been developed and widely used for their solutions. Inspired by rapidly growing impact of deep learning on scientific and engineering research, in this paper we propose a novel neural network, GF-Net, for learning the Green's functions of linear reaction-diffusion equations in an unsupervised fashion. The proposed method overcomes the challenges for finding the Green's functions of the equations on arbitrary domains by utilizing physics-informed approach and the symmetry of the Green's function. As a consequence, it particularly leads to an efficient way for solving the target equations under different boundary conditions and sources. We also demonstrate the effectiveness of the proposed approach by experiments in square, annular and L-shape domains.  ( 2 min )

Despite success in many challenging problems, reinforcement learning (RL) is still confronted with sample inefficiency, which can be mitigated by introducing prior knowledge to agents. However, many transfer techniques in reinforcement learning make the limiting assumption that the teacher is an expert. In this paper, we use the action prior from the Reinforcement Learning as Inference framework - that is, a distribution over actions at each state which resembles a teacher policy, rather than a Bayesian prior - to recover state-of-the-art policy distillation techniques. Then, we propose a class of adaptive methods that can robustly exploit action priors by combining reward shaping and auxiliary regularization losses. In contrast to prior work, we develop algorithms for leveraging suboptimal action priors that may nevertheless impart valuable knowledge - which we call soft action priors. The proposed algorithms adapt by adjusting the strength of teacher feedback according to an estimate of the teacher's usefulness in each state. We perform tabular experiments, which show that the proposed methods achieve state-of-the-art performance, surpassing it when learning from suboptimal priors. Finally, we demonstrate the robustness of the adaptive algorithms in continuous action deep RL problems, in which adaptive algorithms considerably improved stability when compared to existing policy distillation methods.  ( 2 min )

Transformer based models are used to achieve state-of-the-art performance on various deep learning tasks. Since transformer-based models have large numbers of parameters, fine-tuning them on downstream tasks is computationally intensive and energy hungry. Automatic mixed-precision FP32/FP16 fine-tuning of such models has been previously used to lower the compute resource requirements. However, with the recent advances in the low-bit integer back-propagation, it is possible to further reduce the computation and memory foot-print. In this work, we explore a novel integer training method that uses integer arithmetic for both forward propagation and gradient computation of linear, convolutional, layer-norm, and embedding layers in transformer-based models. Furthermore, we study the effect of various integer bit-widths to find the minimum required bit-width for integer fine-tuning of transformer-based models. We fine-tune BERT and ViT models on popular downstream tasks using integer layers. We show that 16-bit integer models match the floating-point baseline performance. Reducing the bit-width to 10, we observe 0.5 average score drop. Finally, further reduction of the bit-width to 8 provides an average score drop of 1.7 points.  ( 2 min )

This paper develops a model-based reinforcement learning (MBRL) framework for learning online the value function of an infinite-horizon optimal control problem while obeying safety constraints expressed as control barrier functions (CBFs). Our approach is facilitated by the development of a novel class of CBFs, termed Lyapunov-like CBFs (LCBFs), that retain the beneficial properties of CBFs for developing minimally-invasive safe control policies while also possessing desirable Lyapunov-like qualities such as positive semi-definiteness. We show how these LCBFs can be used to augment a learning-based control policy to guarantee safety and then leverage this approach to develop a safe exploration framework in a MBRL setting. We demonstrate that our approach can handle more general safety constraints than comparative methods via numerical examples.  ( 2 min )

In this paper, we introduce TITAN, a novel inerTIal block majorizaTion minimizAtioN framework for non-smooth non-convex optimization problems. To the best of our knowledge, TITAN is the first framework of block-coordinate update method that relies on the majorization-minimization framework while embedding inertial force to each step of the block updates. The inertial force is obtained via an extrapolation operator that subsumes heavy-ball and Nesterov-type accelerations for block proximal gradient methods as special cases. By choosing various surrogate functions, such as proximal, Lipschitz gradient, Bregman, quadratic, and composite surrogate functions, and by varying the extrapolation operator, TITAN produces a rich set of inertial block-coordinate update methods. We study sub-sequential convergence as well as global convergence for the generated sequence of TITAN. We illustrate the effectiveness of TITAN on two important machine learning problems, namely sparse non-negative matrix factorization and matrix completion.  ( 2 min )

Bi-layer metallic tube (BMT) plays an extremely crucial role in engineering applications, with rotary draw bending (RDB) the high-precision bending processing can be achieved, however, the product will further springback. Due to the complex structure of BMT and the high cost of dataset acquisi-tion, the existing methods based on mechanism research and machine learn-ing cannot meet the engineering requirements of springback prediction. Based on the preliminary mechanism analysis, a physical logic enhanced network (PE-NET) is proposed. The architecture includes ES-NET which equivalent the BMT to the single-layer tube, and SP-NET for the final predic-tion of springback with sufficient single-layer tube samples. Specifically, in the first stage, with the theory-driven pre-exploration and the data-driven pretraining, the ES-NET and SP-NET are constructed, respectively. In the second stage, under the physical logic, the PE-NET is assembled by ES-NET and SP-NET and then fine-tuned with the small sample BMT dataset and composite loss function. The validity and stability of the proposed method are verified by the FE simulation dataset, the small-sample dataset BMT springback angle prediction is achieved, and the method potential in inter-pretability and engineering applications are demonstrated.  ( 2 min )

Modelling long-range dependencies is critical for scene understanding tasks in computer vision. Although convolution neural networks (CNNs) have excelled in many vision tasks, they are still limited in capturing long-range structured relationships as they typically consist of layers of local kernels. A fully-connected graph, such as the self-attention operation in Transformers, is beneficial for such modelling, however, its computational overhead is prohibitive. In this paper, we propose a dynamic graph message passing network, that significantly reduces the computational complexity compared to related works modelling a fully-connected graph. This is achieved by adaptively sampling nodes in the graph, conditioned on the input, for message passing. Based on the sampled nodes, we dynamically predict node-dependent filter weights and the affinity matrix for propagating information between them. This formulation allows us to design a self-attention module, and more importantly a new Transformer-based backbone network, that we use for both image classification pretraining, and for addressing various downstream tasks (object detection, instance and semantic segmentation). Using this model, we show significant improvements with respect to strong, state-of-the-art baselines on four different tasks. Our approach also outperforms fully-connected graphs while using substantially fewer floating-point operations and parameters. Code and models will be made publicly available at https://github.com/fudan-zvg/DGMN2  ( 2 min )

The cooperative Multi-A gent R einforcement Learning (MARL) with permutation invariant agents framework has achieved tremendous empirical successes in real-world applications. Unfortunately, the theoretical understanding of this MARL problem is lacking due to the curse of many agents and the limited exploration of the relational reasoning in existing works. In this paper, we verify that the transformer implements complex relational reasoning, and we propose and analyze model-free and model-based offline MARL algorithms with the transformer approximators. We prove that the suboptimality gaps of the model-free and model-based algorithms are independent of and logarithmic in the number of agents respectively, which mitigates the curse of many agents. These results are consequences of a novel generalization error bound of the transformer and a novel analysis of the Maximum Likelihood Estimate (MLE) of the system dynamics with the transformer. Our model-based algorithm is the first provably efficient MARL algorithm that explicitly exploits the permutation invariance of the agents.  ( 2 min )

In the absence of nonverbal cues during messaging communication, users express part of their emotions using emojis. Thus, having emojis in the vocabulary of text messaging language models can significantly improve many natural language processing (NLP) applications such as online communication analysis. On the other hand, word embedding models are usually trained on a very large corpus of text such as Wikipedia or Google News datasets that include very few samples with emojis. In this study, we create emojiSpace, which is a combined word-emoji embedding using the word2vec model from the Genism library in Python. We trained emojiSpace on a corpus of more than 4 billion tweets and evaluated it by implementing sentiment analysis on a Twitter dataset containing more than 67 million tweets as an extrinsic task. For this task, we compared the performance of two different classifiers of random forest (RF) and linear support vector machine (SVM). For evaluation, we compared emojiSpace performance with two other pre-trained embeddings and demonstrated that emojiSpace outperforms both.

Throughout computational science, there is a growing need to utilize the continual improvements in raw computational horsepower to achieve greater physical fidelity through scale-bridging over brute-force increases in the number of mesh elements. For instance, quantitative predictions of transport in nanoporous media, critical to hydrocarbon extraction from tight shale formations, are impossible without accounting for molecular-level interactions. Similarly, inertial confinement fusion simulations rely on numerical diffusion to simulate molecular effects such as non-local transport and mixing without truly accounting for molecular interactions. With these two disparate applications in mind, we develop a novel capability which uses an active learning approach to optimize the use of local fine-scale simulations for informing coarse-scale hydrodynamics. Our approach addresses three challenges: forecasting continuum coarse-scale trajectory to speculatively execute new fine-scale molecular dynamics calculations, dynamically updating coarse-scale from fine-scale calculations, and quantifying uncertainty in neural network models.  ( 2 min )

This paper addresses the problem of optimizing charging/discharging schedules of electric vehicles (EVs) when participate in demand response (DR). As there exist uncertainties in EVs' remaining energy, arrival and departure time, and future electricity prices, it is quite difficult to make charging decisions to minimize charging cost while guarantee that the EV's battery state-of-the-charge (SOC) is within certain range. To handle with this dilemma, this paper formulates the EV charging scheduling problem as a constrained Markov decision process (CMDP). By synergistically combining the augmented Lagrangian method and soft actor critic algorithm, a novel safe off-policy reinforcement learning (RL) approach is proposed in this paper to solve the CMDP. The actor network is updated in a policy gradient manner with the Lagrangian value function. A double-critics network is adopted to synchronously estimate the action-value function to avoid overestimation bias. The proposed algorithm does not require strong convexity guarantee of examined problems and is sample efficient. Comprehensive numerical experiments with real-world electricity price demonstrate that our proposed algorithm can achieve high solution optimality and constraints compliance.  ( 2 min )

Chronic pain is a pervasive disorder which is often very disabling and is associated with comorbidities such as depression and anxiety. Neuropathic Pain (NP) is a common sub-type which is often caused due to nerve damage and has a known pathophysiology. Another common sub-type is Fibromyalgia (FM) which is described as musculoskeletal, diffuse pain that is widespread through the body. The pathophysiology of FM is poorly understood, making it very hard to diagnose. Standard medications and treatments for FM and NP differ from one another and if misdiagnosed it can cause an increase in symptom severity. To overcome this difficulty, we propose a novel framework, PainPoints, which accurately detects the sub-type of pain and generates clinical notes via summarizing the patient interviews. Specifically, PainPoints makes use of large language models to perform sentence-level classification of the text obtained from interviews of FM and NP patients with a reliable AUC of 0.83. Using a sufficiency-based interpretability approach, we explain how the fine-tuned model accurately picks up on the nuances that patients use to describe their pain. Finally, we generate summaries of these interviews via expert interventions by introducing a novel facet-based approach. PainPoints thus enables practitioners to add/drop facets and generate a custom summary based on the notion of "facet-coverage" which is also introduced in this work.  ( 3 min )

Graph databases (GDBs) enable processing and analysis of unstructured, complex, rich, and usually vast graph datasets. Despite the large significance of GDBs in both academia and industry, little effort has been made into integrating them with the predictive power of graph neural networks (GNNs). In this work, we show how to seamlessly combine nearly any GNN model with the computational capabilities of GDBs. For this, we observe that the majority of these systems are based on, or support, a graph data model called the Labeled Property Graph (LPG), where vertices and edges can have arbitrarily complex sets of labels and properties. We then develop LPG2vec, an encoder that transforms an arbitrary LPG dataset into a representation that can be directly used with a broad class of GNNs, including convolutional, attentional, message-passing, and even higher-order or spectral models. In our evaluation, we show that the rich information represented as LPG labels and properties is properly preserved by LPG2vec, and it increases the accuracy of predictions regardless of the targeted learning task or the used GNN model, by up to 34% compared to graphs with no LPG labels/properties. In general, LPG2vec enables combining predictive power of the most powerful GNNs with the full scope of information encoded in the LPG model, paving the way for neural graph databases, a class of systems where the vast complexity of maintained data will benefit from modern and future graph machine learning methods.  ( 3 min )

We propose a novel gray-box modeling algorithm for physical systems governed by stochastic differential equations (SDE). The proposed approach, referred to as the Deep Physics Corrector (DPC), blends approximate physics represented in terms of SDE with deep neural network (DNN). The primary idea here is to exploit DNN to model the missing physics. We hypothesize that combining incomplete physics with data will make the model interpretable and allow better generalization. The primary bottleneck associated with training surrogate models for stochastic simulators is often associated with selecting the suitable loss function. Among the different loss functions available in the literature, we use the conditional maximum mean discrepancy (CMMD) loss function in DPC because of its proven performance. Overall, physics-data fusion and CMMD allow DPC to learn from sparse data. We illustrate the performance of the proposed DPC on four benchmark examples from the literature. The results obtained are highly accurate, indicating its possible application as a surrogate model for stochastic simulators.  ( 2 min )

Sports, due to their global reach and impact-rich prediction tasks, are an exciting domain to deploy machine learning models. However, data from conventional sports is often unsuitable for research use due to its size, veracity, and accessibility. To address these issues, we turn to esports, a growing domain that encompasses video games played in a capacity similar to conventional sports. Since esports data is acquired through server logs rather than peripheral sensors, esports provides a unique opportunity to obtain a massive collection of clean and detailed spatiotemporal data, similar to those collected in conventional sports. To parse esports data, we develop awpy, an open-source esports game log parsing library that can extract player trajectories and actions from game logs. Using awpy, we parse 8.6m actions, 7.9m game frames, and 417k trajectories from 1,558 game logs from professional Counter-Strike tournaments to create the Esports Trajectory and Actions (ESTA) dataset. ESTA is one of the largest and most granular publicly available sports data sets to date. We use ESTA to develop benchmarks for win prediction using player-specific information. The ESTA data is available at https://github.com/pnxenopoulos/esta and awpy is made public through PyPI.  ( 2 min )

Incentives that compensate for the involved costs in the decentralized training of a Federated Learning (FL) model act as a key stimulus for clients' long-term participation. However, it is challenging to convince clients for quality participation in FL due to the absence of: (i) full information on the client's data quality and properties; (ii) the value of client's data contributions; and (iii) the trusted mechanism for monetary incentive offers. This often leads to poor efficiency in training and communication. While several works focus on strategic incentive designs and client selection to overcome this problem, there is a major knowledge gap in terms of an overall design tailored to the foreseen digital economy, including Web 3.0, while simultaneously meeting the learning objectives. To address this gap, we propose a contribution-based tokenized incentive scheme, namely \texttt{FedToken}, backed by blockchain technology that ensures fair allocation of tokens amongst the clients that corresponds to the valuation of their data during model training. Leveraging the engineered Shapley-based scheme, we first approximate the contribution of local models during model aggregation, then strategically schedule clients lowering the communication rounds for convergence and anchor ways to allocate \emph{affordable} tokens under a constrained monetary budget. Extensive simulations demonstrate the efficacy of our proposed method.  ( 3 min )

The Resistance: Avalon is a partially observable social deduction game. This area of AI game playing is fairly undeveloped. Implementing an AI for this game involves multiple components specific to each phase as well as role in the game. In this paper, we plan to iteratively develop the required components for each role/phase by first addressing the Assassination phase which can be modeled as a machine learning problem. Using a publicly available dataset from an online version of the game, we train classifiers that emulate an Assassin. After trying various classification techniques, we are able to achieve above average human performance using a simple linear support vector classifier. The eventual goal of this project is to pursue developing an intelligent and complete Avalon player that can play through each phase of the game as any role.  ( 2 min )

The separation between training and deployment of machine learning models implies that not all scenarios encountered in deployment can be anticipated during training, and therefore relying solely on advancements in training has its limits. Out-of-distribution (OOD) detection is an important area that stress-tests a model's ability to handle unseen situations: Do models know when they don't know? Existing OOD detection methods either incur extra training steps, additional data or make nontrivial modifications to the trained network. In contrast, in this work, we propose an extremely simple, post-hoc, on-the-fly activation shaping method, ASH, where a large portion (e.g. 90%) of a sample's activation at a late layer is removed, and the rest (e.g. 10%) simplified or lightly adjusted. The shaping is applied at inference time, and does not require any statistics calculated from training data. Experiments show that such a simple treatment enhances in-distribution and out-of-distribution sample distinction so as to allow state-of-the-art OOD detection on ImageNet, and does not noticeably deteriorate the in-distribution accuracy. We release alongside the paper two calls for explanation and validation, believing the collective power to further validate and understand the discovery. Calls, video and code can be found at: https://andrijazz.github.io/ash  ( 2 min )

The powerful modeling capabilities of all-attention-based transformer architectures often cause overfitting and - for natural language processing tasks - lead to an implicitly learned internal language model in the autoregressive transformer decoder complicating the integration of external language models. In this paper, we explore relaxed attention, a simple and easy-to-implement smoothing of the attention weights, yielding a two-fold improvement to the general transformer architecture: First, relaxed attention provides regularization when applied to the self-attention layers in the encoder. Second, we show that it naturally supports the integration of an external language model as it suppresses the implicitly learned internal language model by relaxing the cross attention in the decoder. We demonstrate the benefit of relaxed attention across several tasks with clear improvement in combination with recent benchmark approaches. Specifically, we exceed the former state-of-the-art performance of 26.90% word error rate on the largest public lip-reading LRS3 benchmark with a word error rate of 26.31%, as well as we achieve a top-performing BLEU score of 37.67 on the IWSLT14 (DE$\rightarrow$EN) machine translation task without external language models and virtually no additional model parameters. Code and models will be made publicly available.  ( 2 min )

Graph Neural Networks (GNNs) have proven to be successful in several predictive modeling tasks for graph-structured data. Amongst those tasks, link prediction is one of the fundamental problems for many real-world applications, such as recommender systems. However, GNNs are not immune to adversarial attacks, i.e., carefully crafted malicious examples that are designed to fool the predictive model. In this work, we focus on a specific, white-box attack to GNN-based link prediction models, where a malicious node aims to appear in the list of recommended nodes for a given target victim. To achieve this goal, the attacker node may also count on the cooperation of other existing peers that it directly controls, namely on the ability to inject a number of ``vicious'' nodes in the network. Specifically, all these malicious nodes can add new edges or remove existing ones, thereby perturbing the original graph. Thus, we propose SAVAGE, a novel framework and a method to mount this type of link prediction attacks. SAVAGE formulates the adversary's goal as an optimization task, striking the balance between the effectiveness of the attack and the sparsity of malicious resources required. Extensive experiments conducted on real-world and synthetic datasets demonstrate that adversarial attacks implemented through SAVAGE indeed achieve high attack success rate yet using a small amount of vicious nodes. Finally, despite those attacks require full knowledge of the target model, we show that they are successfully transferable to other black-box methods for link prediction.  ( 3 min )

Fast Function Extraction (FFX) is a deterministic algorithm for solving symbolic regression problems. We improve the accuracy of FFX by adding parameters to the arguments of nonlinear functions. Instead of only optimizing linear parameters, we optimize these additional nonlinear parameters with separable nonlinear least squared optimization using a variable projection algorithm. Both FFX and our new algorithm is applied on the PennML benchmark suite. We show that the proposed extensions of FFX leads to higher accuracy while providing models of similar length and with only a small increase in runtime on the given data. Our results are compared to a large set of regression methods that were already published for the given benchmark suite.  ( 2 min )

Predicting fund performance is beneficial to both investors and fund managers, and yet is a challenging task. In this paper, we have tested whether deep learning models can predict fund performance more accurately than traditional statistical techniques. Fund performance is typically evaluated by the Sharpe ratio, which represents the risk-adjusted performance to ensure meaningful comparability across funds. We calculated the annualised Sharpe ratios based on the monthly returns time series data for more than 600 open-end mutual funds investing in listed large-cap equities in the United States. We find that long short-term memory (LSTM) and gated recurrent units (GRUs) deep learning methods, both trained with modern Bayesian optimization, provide higher accuracy in forecasting funds' Sharpe ratios than traditional statistical ones. An ensemble method, which combines forecasts from LSTM and GRUs, achieves the best performance of all models. There is evidence to say that deep learning and ensembling offer promising solutions in addressing the challenge of fund performance forecasting.  ( 2 min )

Explainable AI (XAI) is an important developing area but remains relatively understudied for clustering. We propose an explainable-by-design clustering approach that not only finds clusters but also exemplars to explain each cluster. The use of exemplars for understanding is supported by the exemplar-based school of concept definition in psychology. We show that finding a small set of exemplars to explain even a single cluster is computationally intractable; hence, the overall problem is challenging. We develop an approximation algorithm that provides provable performance guarantees with respect to clustering quality as well as the number of exemplars used. This basic algorithm explains all the instances in every cluster whilst another approximation algorithm uses a bounded number of exemplars to allow simpler explanations and provably covers a large fraction of all the instances. Experimental results show that our work is useful in domains involving difficult to understand deep embeddings of images and text.  ( 2 min )

Testing black-box perceptual-control systems in simulation faces two difficulties. Firstly, perceptual inputs in simulation lack the fidelity of real-world sensor inputs. Secondly, for a reasonably accurate perception system, encountering a rare failure trajectory may require running infeasibly many simulations. This paper combines perception error models -- surrogates for a sensor-based detection system -- with state-dependent adaptive importance sampling. This allows us to efficiently assess the rare failure probabilities for real-world perceptual control systems within simulation. Our experiments with an autonomous braking system equipped with an RGB obstacle-detector show that our method can calculate accurate failure probabilities with an inexpensive number of simulations. Further, we show how choice of safety metric can influence the process of learning proposal distributions capable of reliably sampling high-probability failures.  ( 2 min )

Function plays an important role in mathematics and many science branches. As the fast development of computer technology, more and more study on computational function analysis, e.g., Fast Fourier Transform, Wavelet Transform, Curve Function, are presented in these years. However, there are two main problems in these approaches: 1) hard to handle the complex functions of stationary and non-stationary, periodic and non-periodic, high order and low order; 2) hard to generalize the fitting functions from training data to test data. In this paper, a multiple regression based function fitting network that solves the two main problems is introduced as a predicable function fitting technique. This technique constructs the network includes three main parts: 1) the stationary transform layer, 2) the feature encoding layers, and 3) the fine tuning regression layer. The stationary transform layer recognizes the order of input function data, and transforms non-stationary function to stationary function. The feature encoding layers encode the raw input sequential data to a novel linear regression feature that can capture both the structural and the temporal characters of the sequential data. The fine tuning regression layer then fits the features to the target ahead values. The fitting network with the linear regression feature layers and a non-linear regression layer come up with high quality fitting results and generalizable predictions. The experiments of both mathematic function examples and the real word function examples verifies the efficiency of the proposed technique.  ( 3 min )

In detecting malicious websites, a common approach is the use of blacklists which are not exhaustive in themselves and are unable to generalize to new malicious sites. Detecting newly encountered malicious websites automatically will help reduce the vulnerability to this form of attack. In this study, we explored the use of ten machine learning models to classify malicious websites based on lexical features and understand how they generalize across datasets. Specifically, we trained, validated, and tested these models on different sets of datasets and then carried out a cross-datasets analysis. From our analysis, we found that K-Nearest Neighbor is the only model that performs consistently high across datasets. Other models such as Random Forest, Decision Trees, Logistic Regression, and Support Vector Machines also consistently outperform a baseline model of predicting every link as malicious across all metrics and datasets. Also, we found no evidence that any subset of lexical features generalizes across models or datasets. This research should be relevant to cybersecurity professionals and academic researchers as it could form the basis for real-life detection systems or further research work.  ( 2 min )

In recent years, the global Internet of Medical Things (IoMT) industry has evolved at a tremendous speed. Security and privacy are key concerns on the IoMT, owing to the huge scale and deployment of IoMT networks. Machine learning (ML) and blockchain (BC) technologies have significantly enhanced the capabilities and facilities of healthcare 5.0, spawning a new area known as "Smart Healthcare." By identifying concerns early, a smart healthcare system can help avoid long-term damage. This will enhance the quality of life for patients while reducing their stress and healthcare costs. The IoMT enables a range of functionalities in the field of information technology, one of which is smart and interactive health care. However, combining medical data into a single storage location to train a powerful machine learning model raises concerns about privacy, ownership, and compliance with greater concentration. Federated learning (FL) overcomes the preceding difficulties by utilizing a centralized aggregate server to disseminate a global learning model. Simultaneously, the local participant keeps control of patient information, assuring data confidentiality and security. This article conducts a comprehensive analysis of the findings on blockchain technology entangled with federated learning in healthcare. 5.0. The purpose of this study is to construct a secure health monitoring system in healthcare 5.0 by utilizing a blockchain technology and Intrusion Detection System (IDS) to detect any malicious activity in a healthcare network and enables physicians to monitor patients through medical sensors and take necessary measures periodically by predicting diseases.  ( 3 min )

The estimation of 6D poses of rigid objects is a fundamental problem in computer vision. Traditionally pose estimation is concerned with the determination of a single best estimate. However, a single estimate is unable to express visual ambiguity, which in many cases is unavoidable due to object symmetries or occlusion of identifying features. Inability to account for ambiguities in pose can lead to failure in subsequent methods, which is unacceptable when the cost of failure is high. Estimates of full pose distributions are, contrary to single estimates, well suited for expressing uncertainty on pose. Motivated by this, we propose a novel pose distribution estimation method. An implicit formulation of the probability distribution over object pose is derived from an intermediary representation of an object as a set of keypoints. This ensures that the pose distribution estimates have a high level of interpretability. Furthermore, our method is based on conservative approximations, which leads to reliable estimates. The method has been evaluated on the task of rotation distribution estimation on the YCB-V and T-LESS datasets and performs reliably on all objects.  ( 2 min )

Audio-visual source localization is a challenging task that aims to predict the location of visual sound sources in a video. Since collecting ground-truth annotations of sounding objects can be costly, a plethora of weakly-supervised localization methods that can learn from datasets with no bounding-box annotations have been proposed in recent years, by leveraging the natural co-occurrence of audio and visual signals. Despite significant interest, popular evaluation protocols have two major flaws. First, they allow for the use of a fully annotated dataset to perform early stopping, thus significantly increasing the annotation effort required for training. Second, current evaluation metrics assume the presence of sound sources at all times. This is of course an unrealistic assumption, and thus better metrics are necessary to capture the model's performance on (negative) samples with no visible sound sources. To accomplish this, we extend the test set of popular benchmarks, Flickr SoundNet and VGG-Sound Sources, in order to include negative samples, and measure performance using metrics that balance localization accuracy and recall. Using the new protocol, we conducted an extensive evaluation of prior methods, and found that most prior works are not capable of identifying negatives and suffer from significant overfitting problems (rely heavily on early stopping for best results). We also propose a new approach for visual sound source localization that addresses both these problems. In particular, we found that, through extreme visual dropout and the use of momentum encoders, the proposed approach combats overfitting effectively, and establishes a new state-of-the-art performance on both Flickr SoundNet and VGG-Sound Source. Code and pre-trained models are available at https://github.com/stoneMo/SLAVC.  ( 3 min )

Predicting the probability of non-performing loans for individuals has a vital and beneficial role for banks to decrease credit risk and make the right decisions before giving the loan. The trend to make these decisions are based on credit study and in accordance with generally accepted standards, loan payment history, and demographic data of the clients. In this work, we evaluate how different Machine learning models such as Random Forest, Decision tree, KNN, SVM, and XGBoost perform on the dataset provided by a private bank in Ethiopia. Further, motivated by this evaluation we explore different feature selection methods to state the important features for the bank. Our findings show that XGBoost achieves the highest F1 score on the KMeans SMOTE over-sampled data. We also found that the most important features are the age of the applicant, years of employment, and total income of the applicant rather than collateral-related features in evaluating credit risk.  ( 2 min )

We explore efficient evaluation metrics for Natural Language Generation (NLG). To implement efficient metrics, we replace (i) computation-heavy transformers in metrics such as BERTScore, MoverScore, BARTScore, XMoverScore, etc. with lighter versions (such as distilled ones) and (ii) cubic inference time alignment algorithms such as Word Mover Distance with linear and quadratic approximations. We consider six evaluation metrics (both monolingual and multilingual), assessed on three different machine translation datasets, and 16 light-weight transformers as replacement. We find, among others, that (a) TinyBERT shows best quality-efficiency tradeoff for semantic similarity metrics of the BERTScore family, retaining 97\% quality and being 5x faster at inference time on average, (b) there is a large difference in speed-ups on CPU vs. GPU (much higher speed-ups on CPU), and (c) WMD approximations yield no efficiency gains but lead to a substantial drop in quality on 2 out of 3 datasets we examine.  ( 2 min )

Unstructured textual data are at the heart of health systems: liaison letters between doctors, operating reports, coding of procedures according to the ICD-10 standard, etc. The details included in these documents make it possible to get to know the patient better, to better manage him or her, to better study the pathologies, to accurately remunerate the associated medical acts\ldots All this seems to be (at least partially) within reach of today by artificial intelligence techniques. However, for obvious reasons of privacy protection, the designers of these AIs do not have the legal right to access these documents as long as they contain identifying data. De-identifying these documents, i.e. detecting and deleting all identifying information present in them, is a legally necessary step for sharing this data between two complementary worlds. Over the last decade, several proposals have been made to de-identify documents, mainly in English. While the detection scores are often high, the substitution methods are often not very robust to attack. In French, very few methods are based on arbitrary detection and/or substitution rules. In this paper, we propose a new comprehensive de-identification method dedicated to French-language medical documents. Both the approach for the detection of identifying elements (based on deep learning) and their substitution (based on differential privacy) are based on the most proven existing approaches. The result is an approach that effectively protects the privacy of the patients at the heart of these medical documents. The whole approach has been evaluated on a French language medical dataset of a French public hospital and the results are very encouraging.  ( 3 min )

The goal of this work is to help mitigate the already existing gender wage gap by supplying unbiased job recommendations based on resumes from job seekers. We employ a generative adversarial network to remove gender bias from word2vec representations of 12M job vacancy texts and 900k resumes. Our results show that representations created from recruitment texts contain algorithmic bias and that this bias results in real-world consequences for recommendation systems. Without controlling for bias, women are recommended jobs with significantly lower salary in our data. With adversarially fair representations, this wage gap disappears, meaning that our debiased job recommendations reduce wage discrimination. We conclude that adversarial debiasing of word representations can increase real-world fairness of systems and thus may be part of the solution for creating fairness-aware recommendation systems.  ( 2 min )

Uncertainty quantification in automated image analysis is highly desired in many applications. Typically, machine learning models in classification or segmentation are only developed to provide binary answers; however, quantifying the uncertainty of the models can play a critical role for example in active learning or machine human interaction. Uncertainty quantification is especially difficult when using deep learning-based models, which are the state-of-the-art in many imaging applications. The current uncertainty quantification approaches do not scale well in high-dimensional real-world problems. Scalable solutions often rely on classical techniques, such as dropout, during inference or training ensembles of identical models with different random seeds to obtain a posterior distribution. In this paper, we show that these approaches fail to approximate the classification probability. On the contrary, we propose a scalable and intuitive framework to calibrate ensembles of deep learning models to produce uncertainty quantification measurements that approximate the classification probability. On unseen test data, we demonstrate improved calibration, sensitivity (in two out of three cases) and precision when being compared with the standard approaches. We further motivate the usage of our method in active learning, creating pseudo-labels to learn from unlabeled images and human-machine collaboration.  ( 2 min )

Epidemic models are powerful tools in understanding infectious disease. However, as they increase in size and complexity, they can quickly become computationally intractable. Recent progress in modelling methodology has shown that surrogate models can be used to emulate complex epidemic models with a high-dimensional parameter space. We show that deep sequence-to-sequence (seq2seq) models can serve as accurate surrogates for complex epidemic models with sequence based model parameters, effectively replicating seasonal and long-term transmission dynamics. Once trained, our surrogate can predict scenarios a several thousand times faster than the original model, making them ideal for policy exploration. We demonstrate that replacing a traditional epidemic model with a learned simulator facilitates robust Bayesian inference.  ( 2 min )

Industrial and scientific applications handle large volumes of data that render manual validation by humans infeasible. Therefore, we require automated data validation approaches that are able to consider the prior knowledge of domain experts to produce dependable, trustworthy assessments of data quality. Prior knowledge is often available as rules that describe interactions of inputs with regard to the target e.g. the target must be monotonically decreasing and convex over increasing input values. Domain experts are able to validate multiple such interactions at a glance. However, existing rule-based data validation approaches are unable to consider these constraints. In this work, we compare different shape-constrained regression algorithms for the purpose of data validation based on their classification accuracy and runtime performance.  ( 2 min )

We study robust mean estimation in an online and distributed scenario in the presence of adversarial data attacks. At each time step, each agent in a network receives a potentially corrupted data point, where the data points were originally independent and identically distributed samples of a random variable. We propose online and distributed algorithms for all agents to asymptotically estimate the mean. We provide the error-bound and the convergence properties of the estimates to the true mean under our algorithms. Based on the network topology, we further evaluate each agent's trade-off in convergence rate between incorporating data from neighbors and learning with only local observations.  ( 2 min )

Deep learning is playing an increasingly important role in time series analysis. We focused on time series forecasting using attention free mechanism, a more efficient framework, and proposed a new architecture for time series prediction for which linear models seem to be unable to capture the time dependence. We proposed an architecture built using attention free LSTM layers that overcome linear models for conditional variance prediction. Our findings confirm the validity of our model, which also allowed to improve the prediction capacity of a LSTM, while improving the efficiency of the learning task.  ( 2 min )

Combining learned policies in a prioritized, ordered manner is desirable because it allows for modular design and facilitates data reuse through knowledge transfer. In control theory, prioritized composition is realized by null-space control, where low-priority control actions are projected into the null-space of high-priority control actions. Such a method is currently unavailable for Reinforcement Learning. We propose a novel, task-prioritized composition framework for Reinforcement Learning, which involves a novel concept: The indifferent-space of Reinforcement Learning policies. Our framework has the potential to facilitate knowledge transfer and modular design while greatly increasing data efficiency and data reuse for Reinforcement Learning agents. Further, our approach can ensure high-priority constraint satisfaction, which makes it promising for learning in safety-critical domains like robotics. Unlike null-space control, our approach allows learning globally optimal policies for the compound task by online learning in the indifference-space of higher-level policies after initial compound policy construction.  ( 2 min )

Planting vegetation is one of the practical solutions for reducing sediment transfer rates. Increasing vegetation cover decreases environmental pollution and sediment transport rate (STR). Since sediments and vegetation interact complexly, predicting sediment transport rates is challenging. This study aims to predict sediment transport rate under vegetation cover using new and optimized versions of the group method of data handling (GMDH). Additionally, this study introduces a new ensemble model for predicting sediment transport rates. Model inputs include wave height, wave velocity, density cover, wave force, D50, the height of vegetation cover, and cover stem diameter. A standalone GMDH model and optimized GMDH models, including GMDH honey badger algorithm (HBA) GMDH rat swarm algorithm (RSOA)vGMDH sine cosine algorithm (SCA), and GMDH particle swarm optimization (GMDH-PSO), were used to predict sediment transport rates. As the next step, the outputs of standalone and optimized GMDH were used to construct an ensemble model. The MAE of the ensemble model was 0.145 m3/s, while the MAEs of GMDH-HBA, GMDH-RSOA, GMDH-SCA, GMDH-PSOA, and GMDH in the testing level were 0.176 m3/s, 0.312 m3/s, 0.367 m3/s, 0.498 m3/s, and 0.612 m3/s, respectively. The Nash Sutcliffe coefficient (NSE) of ensemble model, GMDH-HBA, GMDH-RSOA, GMDH-SCA, GMDH-PSOA, and GHMDH were 0.95 0.93, 0.89, 0.86, 0.82, and 0.76, respectively. Additionally, this study demonstrated that vegetation cover decreased sediment transport rate by 90 percent. The results indicated that the ensemble and GMDH-HBA models could accurately predict sediment transport rates. Based on the results of this study, sediment transport rate can be monitored using the IMM and GMDH-HBA. These results are useful for managing and planning water resources in large basins.  ( 3 min )

When answering a question, humans utilize the information available across different modalities to synthesize a consistent and complete chain of thought (CoT). This process is normally a black box in the case of deep learning models like large-scale language models. Recently, science question benchmarks have been used to diagnose the multi-hop reasoning ability and interpretability of an AI system. However, existing datasets fail to provide annotations for the answers, or are restricted to the textual-only modality, small scales, and limited domain diversity. To this end, we present Science Question Answering (SQA), a new benchmark that consists of ~21k multimodal multiple choice questions with a diverse set of science topics and annotations of their answers with corresponding lectures and explanations. We further design language models to learn to generate lectures and explanations as the chain of thought (CoT) to mimic the multi-hop reasoning process when answering SQA questions. SQA demonstrates the utility of CoT in language models, as CoT improves the question answering performance by 1.20% in few-shot GPT-3 and 3.99% in fine-tuned UnifiedQA. We also explore the upper bound for models to leverage explanations by feeding those in the input; we observe that it improves the few-shot performance of GPT-3 by 18.96%. Our analysis further shows that language models, similar to humans, benefit from explanations to learn from fewer data and achieve the same performance with just 40% of the data.  ( 3 min )

Attention-based neural networks have become pervasive in many AI tasks. Despite their excellent algorithmic performance, the use of the attention mechanism and feed-forward network (FFN) demands excessive computational and memory resources, which often compromises their hardware performance. Although various sparse variants have been introduced, most approaches only focus on mitigating the quadratic scaling of attention on the algorithm level, without explicitly considering the efficiency of mapping their methods on real hardware designs. Furthermore, most efforts only focus on either the attention mechanism or the FFNs but without jointly optimizing both parts, causing most of the current designs to lack scalability when dealing with different input lengths. This paper systematically considers the sparsity patterns in different variants from a hardware perspective. On the algorithmic level, we propose FABNet, a hardware-friendly variant that adopts a unified butterfly sparsity pattern to approximate both the attention mechanism and the FFNs. On the hardware level, a novel adaptable butterfly accelerator is proposed that can be configured at runtime via dedicated hardware control to accelerate different butterfly layers using a single unified hardware engine. On the Long-Range-Arena dataset, FABNet achieves the same accuracy as the vanilla Transformer while reducing the amount of computation by 10 to 66 times and the number of parameters 2 to 22 times. By jointly optimizing the algorithm and hardware, our FPGA-based butterfly accelerator achieves 14.2 to 23.2 times speedup over state-of-the-art accelerators normalized to the same computational budget. Compared with optimized CPU and GPU designs on Raspberry Pi 4 and Jetson Nano, our system is up to 273.8 and 15.1 times faster under the same power budget.  ( 3 min )

Naive Bayes has been widely used in many applications because of its simplicity and ability in handling both numerical data and categorical data. However, lack of modeling of correlations between features limits its performance. In addition, noise and outliers in the real-world dataset also greatly degrade the classification performance. In this paper, we propose a feature augmentation method employing a stack auto-encoder to reduce the noise in the data and boost the discriminant power of naive Bayes. The proposed stack auto-encoder consists of two auto-encoders for different purposes. The first encoder shrinks the initial features to derive a compact feature representation in order to remove the noise and redundant information. The second encoder boosts the discriminant power of the features by expanding them into a higher-dimensional space so that different classes of samples could be better separated in the higher-dimensional space. By integrating the proposed feature augmentation method with the regularized naive Bayes, the discrimination power of the model is greatly enhanced. The proposed method is evaluated on a set of machine-learning benchmark datasets. The experimental results show that the proposed method significantly and consistently outperforms the state-of-the-art naive Bayes classifiers.  ( 2 min )

Integer sequences are of central importance to the modeling of concepts admitting complete finitary descriptions. We introduce a novel view on the learning of such concepts and lay down a set of benchmarking tasks aimed at conceptual understanding by machine learning models. These tasks indirectly assess model ability to abstract, and challenge them to reason both interpolatively and extrapolatively from the knowledge gained by observing representative examples. To further aid research in knowledge representation and reasoning, we present FACT, the Finitary Abstraction Comprehension Toolkit. The toolkit surrounds a large dataset of integer sequences comprising both organic and synthetic entries, a library for data pre-processing and generation, a set of model performance evaluation tools, and a collection of baseline model implementations, enabling the making of the future advancements with ease.  ( 2 min )

The evaluation of clustering algorithms can be performed by running them on a variety of benchmark problems, and comparing their outputs to the reference, ground-truth groupings provided by experts. Unfortunately, many research papers and graduate theses consider only a small number of datasets. Also, rarely the fact that there can be many equally valid ways to cluster a given problem set is taken into account. In order to overcome these limitations, we have developed a framework whose aim is to introduce a consistent methodology for testing clustering algorithms. Furthermore, we have aggregated, polished, and standardised many clustering benchmark batteries referred to across the machine learning and data mining literature, and included new datasets of different dimensionalities, sizes, and cluster types. An interactive datasets explorer, the documentation of the Python API, a description of the ways to interact with the framework from other programming languages such as R or MATLAB, and other details are all provided at https://clustering-benchmarks.gagolewski.com.  ( 2 min )

Complementary-Label Learning (CLL) is a weakly-supervised learning problem that aims to learn a multi-class classifier from only complementary labels, which indicate a class to which an instance does not belong. Existing approaches mainly adopt the paradigm of reduction to ordinary classification, which applies specific transformations and surrogate losses to connect CLL back to ordinary classification. Those approaches, however, face several limitations, such as the tendency to overfit or be hooked on deep models. In this paper, we sidestep those limitations with a novel perspective--reduction to probability estimates of complementary classes. We prove that accurate probability estimates of complementary labels lead to good classifiers through a simple decoding step. The proof establishes a reduction framework from CLL to probability estimates. The framework offers explanations of several key CLL approaches as its special cases and allows us to design an improved algorithm that is more robust in noisy environments. The framework also suggests a validation procedure based on the quality of probability estimates, leading to an alternative way to validate models with only complementary labels. The flexible framework opens a wide range of unexplored opportunities in using deep and non-deep models for probability estimates to solve the CLL problem. Empirical experiments further verified the framework's efficacy and robustness in various settings.  ( 2 min )

We tackle the challenge of feature embedding for the purposes of improving the click-through rate prediction process. We select three models: logistic regression, factorization machines and deep factorization machines, as our baselines and propose five different feature embedding modules: embedding scaling, FM embedding, embedding encoding, NN embedding and the embedding reweighting module. The embedding modules act as a way to improve baseline model feature embeddings and are trained alongside the rest of the model parameters in an end-to-end manner. Each module is individually added to a baseline model to obtain a new augmented model. We test the predictive performance of our augmented models on a publicly accessible dataset used for benchmarking click-through rate prediction models. Our results show that several proposed embedding modules provide an important increase in predictive performance without a drastic increase in training time.  ( 2 min )

Deep Neural Networks (DNNs) are generally designed as sequentially cascaded differentiable blocks/layers with a prediction module connected only to its last layer. DNNs can be attached with prediction modules at multiple points along the backbone where inference can stop at an intermediary stage without passing through all the modules. The last exit point may offer a better prediction error but also involves more computational resources and latency. An exit point that is `optimal' in terms of both prediction error and cost is desirable. The optimal exit point may depend on the latent distribution of the tasks and may change from one task type to another. During neural inference, the ground truth of instances may not be available and error rates at each exit point cannot be estimated. Hence one is faced with the problem of selecting the optimal exit in an unsupervised setting. Prior works tackled this problem in an offline supervised setting assuming that enough labeled data is available to estimate the error rate at each exit point and tune the parameters for better accuracy. However, pre-trained DNNs are often deployed in new domains for which a large amount of ground truth may not be available. We model the problem of exit selection as an unsupervised online learning problem and use bandit theory to identify the optimal exit point. Specifically, we focus on Elastic BERT, a pre-trained multi-exit DNN to demonstrate that it `nearly' satisfies the Strong Dominance (SD) property making it possible to learn the optimal exit in an online setup without knowing the ground truth labels. We develop upper confidence bound (UCB) based algorithm named UEE-UCB that provably achieves sub-linear regret under the SD property. Thus our method provides a means to adaptively learn domain-specific optimal exit points in multi-exit DNNs. We empirically validate our algorithm on IMDb and Yelp datasets.  ( 3 min )

Supernova spectral time series can be used to reconstruct a spatially resolved explosion model known as supernova tomography. In addition to an observed spectral time series, a supernova tomography requires a radiative transfer model to perform the inverse problem with uncertainty quantification for a reconstruction. The smallest parametrizations of supernova tomography models are roughly a dozen parameters with a realistic one requiring more than 100. Realistic radiative transfer models require tens of CPU minutes for a single evaluation making the problem computationally intractable with traditional means requiring millions of MCMC samples for such a problem. A new method for accelerating simulations known as surrogate models or emulators using machine learning techniques offers a solution for such problems and a way to understand progenitors/explosions from spectral time series. There exist emulators for the TARDIS supernova radiative transfer code but they only perform well on simplistic low-dimensional models (roughly a dozen parameters) with a small number of applications for knowledge gain in the supernova field. In this work, we present a new emulator for the radiative transfer code TARDIS that not only outperforms existing emulators but also provides uncertainties in its prediction. It offers the foundation for a future active-learning-based machinery that will be able to emulate very high dimensional spaces of hundreds of parameters crucial for unraveling urgent questions in supernovae and related fields.  ( 3 min )

Existing work in continual learning (CL) focuses on mitigating catastrophic forgetting, i.e., model performance deterioration on past tasks when learning a new task. However, the training efficiency of a CL system is under-investigated, which limits the real-world application of CL systems under resource-limited scenarios. In this work, we propose a novel framework called Sparse Continual Learning(SparCL), which is the first study that leverages sparsity to enable cost-effective continual learning on edge devices. SparCL achieves both training acceleration and accuracy preservation through the synergy of three aspects: weight sparsity, data efficiency, and gradient sparsity. Specifically, we propose task-aware dynamic masking (TDM) to learn a sparse network throughout the entire CL process, dynamic data removal (DDR) to remove less informative training data, and dynamic gradient masking (DGM) to sparsify the gradient updates. Each of them not only improves efficiency, but also further mitigates catastrophic forgetting. SparCL consistently improves the training efficiency of existing state-of-the-art (SOTA) CL methods by at most 23X less training FLOPs, and, surprisingly, further improves the SOTA accuracy by at most 1.7%. SparCL also outperforms competitive baselines obtained from adapting SOTA sparse training methods to the CL setting in both efficiency and accuracy. We also evaluate the effectiveness of SparCL on a real mobile phone, further indicating the practical potential of our method.  ( 3 min )

Automatic sleep scoring is essential for the diagnosis and treatment of sleep disorders and enables longitudinal sleep tracking in home environments. Conventionally, learning-based automatic sleep scoring on single-channel electroencephalogram (EEG) is actively studied because obtaining multi-channel signals during sleep is difficult. However, learning representation from raw EEG signals is challenging owing to the following issues: 1) sleep-related EEG patterns occur on different temporal and frequency scales and 2) sleep stages share similar EEG patterns. To address these issues, we propose a deep learning framework named SleePyCo that incorporates 1) a feature pyramid and 2) supervised contrastive learning for automatic sleep scoring. For the feature pyramid, we propose a backbone network named SleePyCo-backbone to consider multiple feature sequences on different temporal and frequency scales. Supervised contrastive learning allows the network to extract class discriminative features by minimizing the distance between intra-class features and simultaneously maximizing that between inter-class features. Comparative analyses on four public datasets demonstrate that SleePyCo consistently outperforms existing frameworks based on single-channel EEG. Extensive ablation experiments show that SleePyCo exhibits enhanced overall performance, with significant improvements in discrimination between the N1 and rapid eye movement (REM) stages.  ( 2 min )

Crowd sequential annotations can be an efficient and cost-effective way to build large datasets for sequence labeling. Different from tagging independent instances, for crowd sequential annotations the quality of label sequence relies on the expertise level of annotators in capturing internal dependencies for each token in the sequence. In this paper, we propose Modeling sequential annotation for sequence labeling with crowds (SA-SLC). First, a conditional probabilistic model is developed to jointly model sequential data and annotators' expertise, in which categorical distribution is introduced to estimate the reliability of each annotator in capturing local and non-local label dependency for sequential annotation. To accelerate the marginalization of the proposed model, a valid label sequence inference (VLSE) method is proposed to derive the valid ground-truth label sequences from crowd sequential annotations. VLSE derives possible ground-truth labels from the token-wise level and further prunes sub-paths in the forward inference for label sequence decoding. VLSE reduces the number of candidate label sequences and improves the quality of possible ground-truth label sequences. The experimental results on several sequence labeling tasks of Natural Language Processing show the effectiveness of the proposed model.  ( 2 min )

The spread of COVID-19 revealed that transmission risk patterns are not homogenous across different cities and communities, and various heterogeneous features can influence the spread trajectories. Hence, for predictive pandemic monitoring, it is essential to explore latent heterogeneous features in cities and communities that distinguish their specific pandemic spread trajectories. To this end, this study creates a network embedding model capturing cross-county visitation networks, as well as heterogeneous features to uncover clusters of counties in the United States based on their pandemic spread transmission trajectories. We collected and computed location intelligence features from 2,787 counties from March 3 to June 29, 2020 (initial wave). Second, we constructed a human visitation network, which incorporated county features as node attributes, and visits between counties as network edges. Our attributed network embeddings approach integrates both typological characteristics of the cross-county visitation network, as well as heterogeneous features. We conducted clustering analysis on the attributed network embeddings to reveal four archetypes of spread risk trajectories corresponding to four clusters of counties. Subsequently, we identified four features as important features underlying the distinctive transmission risk patterns among the archetypes. The attributed network embedding approach and the findings identify and explain the non-homogenous pandemic risk trajectories across counties for predictive pandemic monitoring. The study also contributes to data-driven and deep learning-based approaches for pandemic analytics to complement the standard epidemiological models for policy analysis in pandemics.  ( 3 min )

Existing disambiguation strategies for partial structured output learning just cannot generalize well to solve the problem that there are some candidates which can be false positive or similar to the ground-truth label. In this paper, we propose a novel weak disambiguation for partial structured output learning (WD-PSL). First, a piecewise large margin formulation is generalized to partial structured output learning, which effectively avoids handling large number of candidate structured outputs for complex structures. Second, in the proposed weak disambiguation strategy, each candidate label is assigned with a confidence value indicating how likely it is the true label, which aims to reduce the negative effects of wrong ground-truth label assignment in the learning process. Then two large margins are formulated to combine two types of constraints which are the disambiguation between candidates and non-candidates, and the weak disambiguation for candidates. In the framework of alternating optimization, a new 2n-slack variables cutting plane algorithm is developed to accelerate each iteration of optimization. The experimental results on several sequence labeling tasks of Natural Language Processing show the effectiveness of the proposed model.  ( 2 min )

Self-supervised neural language models have recently found wide applications in generative design of organic molecules and protein sequences as well as representation learning for downstream structure classification and functional prediction. However, most of the existing deep learning models for molecule design usually require a big dataset and have a black-box architecture, which makes it difficult to interpret their design logic. Here we propose Generative Molecular Transformer (GMTransformer), a probabilistic neural network model for generative design of molecules. Our model is built on the blank filling language model originally developed for text processing, which has demonstrated unique advantages in learning the "molecules grammars" with high-quality generation, interpretability, and data efficiency. Benchmarked on the MOSES datasets, our models achieve high novelty and Scaf compared to other baselines. The probabilistic generation steps have the potential in tinkering molecule design due to their capability of recommending how to modify existing molecules with explanation, guided by the learned implicit molecule chemistry. The source code and datasets can be accessed freely at https://github.com/usccolumbia/GMTransformer  ( 2 min )

In various control task domains, existing controllers provide a baseline level of performance that -- though possibly suboptimal -- should be maintained. Reinforcement learning (RL) algorithms that rely on extensive exploration of the state and action space can be used to optimize a control policy. However, fully exploratory RL algorithms may decrease performance below a baseline level during training. In this paper, we address the issue of online optimization of a control policy while minimizing regret w.r.t a baseline policy performance. We present a joint imitation-reinforcement learning framework, denoted JIRL. The learning process in JIRL assumes the availability of a baseline policy and is designed with two objectives in mind \textbf{(a)} leveraging the baseline's online demonstrations to minimize the regret w.r.t the baseline policy during training, and \textbf{(b)} eventually surpassing the baseline performance. JIRL addresses these objectives by initially learning to imitate the baseline policy and gradually shifting control from the baseline to an RL agent. Experimental results show that JIRL effectively accomplishes the aforementioned objectives in several, continuous action-space domains. The results demonstrate that JIRL is comparable to a state-of-the-art algorithm in its final performance while incurring significantly lower baseline regret during training in all of the presented domains. Moreover, the results show a reduction factor of up to $21$ in baseline regret over a state-of-the-art baseline regret minimization approach.  ( 3 min )

Coherent microscopy techniques provide an unparalleled multi-scale view of materials across scientific and technological fields, from structural materials to quantum devices, from integrated circuits to biological cells. Driven by the construction of brighter sources and high-rate detectors, coherent X-ray microscopy methods like ptychography are poised to revolutionize nanoscale materials characterization. However, associated significant increases in data and compute needs mean that conventional approaches no longer suffice for recovering sample images in real-time from high-speed coherent imaging experiments. Here, we demonstrate a workflow that leverages artificial intelligence at the edge and high-performance computing to enable real-time inversion on X-ray ptychography data streamed directly from a detector at up to 2 kHz. The proposed AI-enabled workflow eliminates the sampling constraints imposed by traditional ptychography, allowing low dose imaging using orders of magnitude less data than required by traditional methods.  ( 2 min )

The multi-armed bandit(MAB) problem is a simple yet powerful framework that has been extensively studied in the context of decision-making under uncertainty. In many real-world applications, such as robotic applications, selecting an arm corresponds to a physical action that constrains the choices of the next available arms (actions). Motivated by this, we study an extension of MAB called the graph bandit, where an agent travels over a graph trying to maximize the reward collected from different nodes. The graph defines the freedom of the agent in selecting the next available nodes at each step. We assume the graph structure is fully available, but the reward distributions are unknown. Built upon an offline graph-based planning algorithm and the principle of optimism, we design an online learning algorithm that balances long-term exploration-exploitation using the principle of optimism. We show that our proposed algorithm achieves $O(|S|\sqrt{T}\log(T)+D|S|\log T)$ learning regret, where $|S|$ is the number of nodes and $D$ is the diameter of the graph, which is superior compared to the best-known reinforcement learning algorithms under similar settings. Numerical experiments confirm that our algorithm outperforms several benchmarks. Finally, we present a synthetic robotic application modeled by the graph bandit framework, where a robot moves on a network of rural/suburban locations to provide high-speed internet access using our proposed algorithm.  ( 3 min )

Existing partial sequence labeling models mainly focus on max-margin framework which fails to provide an uncertainty estimation of the prediction. Further, the unique ground truth disambiguation strategy employed by these models may include wrong label information for parameter learning. In this paper, we propose structured Gaussian Processes for partial sequence labeling (SGPPSL), which encodes uncertainty in the prediction and does not need extra effort for model selection and hyperparameter learning. The model employs factor-as-piece approximation that divides the linear-chain graph structure into the set of pieces, which preserves the basic Markov Random Field structure and effectively avoids handling large number of candidate output sequences generated by partially annotated data. Then confidence measure is introduced in the model to address different contributions of candidate labels, which enables the ground-truth label information to be utilized in parameter learning. Based on the derived lower bound of the variational lower bound of the proposed model, variational parameters and confidence measures are estimated in the framework of alternating optimization. Moreover, weighted Viterbi algorithm is proposed to incorporate confidence measure to sequence prediction, which considers label ambiguity arose from multiple annotations in the training data and thus helps improve the performance. SGPPSL is evaluated on several sequence labeling tasks and the experimental results show the effectiveness of the proposed model.  ( 3 min )

Quantum computing offers the potential of exponential speedup over classical computation for certain problems. However, many of the existing algorithms with provable speedups require currently unavailable fault-tolerant quantum computers. We present NISQ-TDA, the first fully implemented quantum machine learning algorithm with provable exponential speedup on arbitrary classical (non-handcrafted) data and needing only a linear circuit depth. We report the successful execution of our NISQ-TDA algorithm, applied to small datasets run on quantum computing devices, as well as on noisy quantum simulators. We empirically confirm that the algorithm is robust to noise, and provide target depths and noise levels to realize near-term, non-fault-tolerant quantum advantage on real-world problems. Our unique data-loading projection method is the main source of noise robustness, introducing a new self-correcting data-loading approach.  ( 2 min )

Prompting, which casts downstream applications as language modeling tasks, has shown to be sample efficient compared to standard fine-tuning with pre-trained models. However, one pitfall of prompting is the need of manually-designed patterns, whose outcome can be unintuitive and requires large validation sets to tune. To tackle the challenge, we propose AutoSeq, a fully automatic prompting method: (1) We adopt natural language prompts on sequence-to-sequence models, enabling free-form generation and larger label search space; (2) We propose label sequences -- phrases with indefinite lengths to verbalize the labels -- which eliminate the need of manual templates and are more expressive than single label words; (3) We use beam search to automatically generate a large amount of label sequence candidates and propose contrastive re-ranking to get the best combinations. AutoSeq significantly outperforms other no-manual-design methods, such as soft prompt tuning, adapter tuning, and automatic search on single label words; the generated label sequences are even better than curated manual ones on a variety of tasks. Our method reveals the potential of sequence-to-sequence models in few-shot learning and sheds light on a path to generic and automatic prompting. The source code of this paper can be obtained from https://github.com/thunlp/Seq2Seq-Prompt.  ( 2 min )

Implicit models are a general class of learning models that forgo the hierarchical layer structure typical in neural networks and instead define the internal states based on an ``equilibrium'' equation, offering competitive performance and reduced memory consumption. However, training such models usually relies on expensive implicit differentiation for backward propagation. In this work, we present a new approach to training implicit models, called State-driven Implicit Modeling (SIM), where we constrain the internal states and outputs to match that of a baseline model, circumventing costly backward computations. The training problem becomes convex by construction and can be solved in a parallel fashion, thanks to its decomposable structure. We demonstrate how the SIM approach can be applied to significantly improve sparsity (parameter reduction) and robustness of baseline models trained on FashionMNIST and CIFAR-100 datasets.  ( 2 min )

This paper examines two different yet related questions related to explainable AI (XAI) practices. Machine learning (ML) is increasingly important in financial services, such as pre-approval, credit underwriting, investments, and various front-end and back-end activities. Machine Learning can automatically detect non-linearities and interactions in training data, facilitating faster and more accurate credit decisions. However, machine learning models are opaque and hard to explain, which are critical elements needed for establishing a reliable technology. The study compares various machine learning models, including single classifiers (logistic regression, decision trees, LDA, QDA), heterogeneous ensembles (AdaBoost, Random Forest), and sequential neural networks. The results indicate that ensemble classifiers and neural networks outperform. In addition, two advanced post-hoc model agnostic explainability techniques - LIME and SHAP are utilized to assess ML-based credit scoring models using the open-access datasets offered by US-based P2P Lending Platform, Lending Club. For this study, we are also using machine learning algorithms to develop new investment models and explore portfolio strategies that can maximize profitability while minimizing risk.  ( 2 min )

Most soft-body organisms found in nature exist in underwater environments. It is helpful to study the motion and control of soft robots underwater as well. However, a readily available underwater soft robotic system is not available for researchers to use because they are difficult to design, fabricate, and waterproof. Furthermore, submersible robots usually do not have configurable components because of the need for sealed electronics packages. This work presents the development of a submersible soft robotic arm driven by hydraulic actuators which consists of mostly 3D printable parts which can be assembled in a short amount of time. Also, its modular design enables multiple shape configurations and easy swapping of soft actuators. As a first step to exploring machine learning control algorithms on this system, two deep neural network models were developed, trained, and evaluated to estimate the robot's forward and inverse kinematics. The techniques developed for controlling this underwater soft robotic arm can help advance understanding on how to control soft robotic systems in general.  ( 2 min )

Optics and lenses are abstract categorical gadgets that model systems with bidirectional data flow. In this paper we observe that the denotational definition of optics - identifying two optics as equivalent by observing their behaviour from the outside - is not suitable for operational, software oriented approaches where optics are not merely observed, but built with their internal setups in mind. We identify operational differences between denotationally isomorphic categories of cartesian optics and lenses: their different composition rule and corresponding space-time tradeoffs, positioning them at two opposite ends of a spectrum. With these motivations we lift the existing categorical constructions and their relationships to the 2-categorical level, showing that the relevant operational concerns become visible. We define the 2-category $\textbf{2-Optic}(\mathcal{C})$ whose 2-cells explicitly track optics' internal configuration. We show that the 1-category $\textbf{Optic}(\mathcal{C})$ arises by locally quotienting out the connected components of this 2-category. We show that the embedding of lenses into cartesian optics gets weakened from a functor to an oplax functor whose oplaxator now detects the different composition rule. We determine the difficulties in showing this functor forms a part of an adjunction in any of the standard 2-categories. We establish a conjecture that the well-known isomorphism between cartesian lenses and optics arises out of the lax 2-adjunction between their double-categorical counterparts. In addition to presenting new research, this paper is also meant to be an accessible introduction to the topic.  ( 3 min )

Although the no-u-turn sampler (NUTS) is a widely adopted method for performing Bayesian inference, it requires numerous posterior gradients which can be expensive to compute in practice. Recently, there has been a significant interest in physics-based machine learning of dynamical (or Hamiltonian) systems and Hamiltonian neural networks (HNNs) is a noteworthy architecture. But these types of architectures have not been applied to solve Bayesian inference problems efficiently. We propose the use of HNNs for performing Bayesian inference efficiently without requiring numerous posterior gradients. We introduce latent variable outputs to HNNs (L-HNNs) for improved expressivity and reduced integration errors. We integrate L-HNNs in NUTS and further propose an online error monitoring scheme to prevent sampling degeneracy in regions where L-HNNs may have little training data. We demonstrate L-HNNs in NUTS with online error monitoring considering several complex high-dimensional posterior densities and compare its performance to NUTS.  ( 2 min )

Current graph representation learning techniques use Graph Neural Networks (GNNs) to extract features from dataset embeddings. In this work, we examine the quality of these embeddings and assess how changing them can affect the accuracy of GNNs. We explore different embedding extraction techniques for both images and texts. We find that the choice of embedding biases the performance of different GNN architectures and thus the choice of embedding influences the selection of GNNs regardless of the underlying dataset. In addition, we only see an improvement in accuracy from some GNN models compared to the accuracy of models trained from scratch or fine-tuned on the underlying data without utilizing the graph connections. As an alternative, we propose Graph-connected Network (GraNet) layers which use GNN message passing within large models to allow neighborhood aggregation. This gives a chance for the model to inherit weights from large pre-trained models if possible and we demonstrate that this approach improves the accuracy compared to the previous methods: on Flickr_v2, GraNet beats GAT2 and GraphSAGE by 7.7% and 1.7% respectively.  ( 2 min )

There is currently a large gap in performance between the statistically rigorous methods like linear regression or additive splines and the powerful deep methods using neural networks. Previous works attempting to close this gap have failed to fully investigate the exponentially growing number of feature combinations which deep networks consider automatically during training. In this work, we develop a tractable selection algorithm to efficiently identify the necessary feature combinations by leveraging techniques in feature interaction detection. Our proposed Sparse Interaction Additive Networks (SIAN) construct a bridge from these simple and interpretable models to fully connected neural networks. SIAN achieves competitive performance against state-of-the-art methods across multiple large-scale tabular datasets and consistently finds an optimal tradeoff between the modeling capacity of neural networks and the generalizability of simpler methods.  ( 2 min )

Visible-infrared person re-identification (ReID) aims to recognize a same person of interest across a network of RGB and IR cameras. Some deep learning (DL) models have directly incorporated both modalities to discriminate persons in a joint representation space. However, this cross-modal ReID problem remains challenging due to the large domain shift in data distributions between RGB and IR modalities. % This paper introduces a novel approach for a creating intermediate virtual domain that acts as bridges between the two main domains (i.e., RGB and IR modalities) during training. This intermediate domain is considered as privileged information (PI) that is unavailable at test time, and allows formulating this cross-modal matching task as a problem in learning under privileged information (LUPI). We devised a new method to generate images between visible and infrared domains that provide additional information to train a deep ReID model through an intermediate domain adaptation. In particular, by employing color-free and multi-step triplet loss objectives during training, our method provides common feature representation spaces that are robust to large visible-infrared domain shifts. % Experimental results on challenging visible-infrared ReID datasets indicate that our proposed approach consistently improves matching accuracy, without any computational overhead at test time. The code is available at: \href{https://github.com/alehdaghi/Cross-Modal-Re-ID-via-LUPI}{https://github.com/alehdaghi/Cross-Modal-Re-ID-via-LUPI}  ( 2 min )

Simulating trajectories of virtual crowds is a commonly encountered task in Computer Graphics. Several recent works have applied Reinforcement Learning methods to animate virtual agents, however they often make different design choices when it comes to the fundamental simulation setup. Each of these choices comes with a reasonable justification for its use, so it is not obvious what is their real impact, and how they affect the results. In this work, we analyze some of these arbitrary choices in terms of their impact on the learning performance, as well as the quality of the resulting simulation measured in terms of the energy efficiency. We perform a theoretical analysis of the properties of the reward function design, and empirically evaluate the impact of using certain observation and action spaces on a variety of scenarios, with the reward function and energy usage as metrics. We show that directly using the neighboring agents' information as observation generally outperforms the more widely used raycasting. Similarly, using nonholonomic controls with egocentric observations tends to produce more efficient behaviors than holonomic controls with absolute observations. Each of these choices has a significant, and potentially nontrivial impact on the results, and so researchers should be mindful about choosing and reporting them in their work.  ( 3 min )

Learning control policies with large action spaces is a challenging problem in the field of reinforcement learning due to present inefficiencies in exploration. In this work, we introduce a Deep Reinforcement Learning (DRL) algorithm call Multi-Action Networks (MAN) Learning that addresses the challenge of large discrete action spaces. We propose separating the action space into two components, creating a Value Neural Network for each sub-action. Then, MAN uses temporal-difference learning to train the networks synchronously, which is simpler than training a single network with a large action output directly. To evaluate the proposed method, we test MAN on a block stacking task, and then extend MAN to handle 12 games from the Atari Arcade Learning environment with 18 action spaces. Our results indicate that MAN learns faster than both Deep Q-Learning and Double Deep Q-Learning, implying our method is a better performing synchronous temporal difference algorithm than those currently available for large action spaces.  ( 2 min )

In the era of loT (Internet of Things) we are surrounded by a plethora of Al enabled devices that can transcribe images, video, audio, and sensors signals into text descriptions. When such transcriptions are captured in activity reports for monitoring, life logging and anomaly detection applications, a user would typically request a summary or ask targeted questions about certain sections of the report they are interested in. Depending on the context and the type of question asked, a question answering (QA) system would need to automatically determine whether the answer covers single-span or multi-span text components. Currently available QA datasets primarily focus on single span responses only (such as SQuAD[4]) or contain a low proportion of examples with multiple span answers (such as DROP[3]). To investigate automatic selection of single/multi-span answers in the use case described, we created a new smart home environment dataset comprised of questions paired with single-span or multi-span answers depending on the question and context queried. In addition, we propose a RoBERTa[6]-based multiple span extraction question answering (MSEQA) model returning the appropriate answer span for a given question. Our experiments show that the proposed model outperforms state-of-the-art QA models on our dataset while providing comparable performance on published individual single/multi-span task datasets.  ( 2 min )

Meta-learning is a branch of machine learning which aims to synthesize data from a distribution of related tasks to efficiently solve new ones. In process control, many systems have similar and well-understood dynamics, which suggests it is feasible to create a generalizable controller through meta-learning. In this work, we formulate a meta reinforcement learning (meta-RL) control strategy that takes advantage of known, offline information for training, such as a model structure. The meta-RL agent is trained over a distribution of model parameters, rather than a single model, enabling the agent to automatically adapt to changes in the process dynamics while maintaining performance. A key design element is the ability to leverage model-based information offline during training, while maintaining a model-free policy structure for interacting with new environments. Our previous work has demonstrated how this approach can be applied to the industrially-relevant problem of tuning proportional-integral controllers to control first order processes. In this work, we briefly reintroduce our methodology and demonstrate how it can be extended to proportional-integral-derivative controllers and second order systems.  ( 2 min )

We bound the excess risk of interpolating deep linear networks trained using gradient flow. In a setting previously used to establish risk bounds for the minimum $\ell_2$-norm interpolant, we show that randomly initialized deep linear networks can closely approximate or even match known bounds for the minimum $\ell_2$-norm interpolant. Our analysis also reveals that interpolating deep linear models have exactly the same conditional variance as the minimum $\ell_2$-norm solution. Since the noise affects the excess risk only through the conditional variance, this implies that depth does not improve the algorithm's ability to "hide the noise". Our simulations verify that aspects of our bounds reflect typical behavior for simple data distributions. We also find that similar phenomena are seen in simulations with ReLU networks, although the situation there is more nuanced.  ( 2 min )

Recent advances in vision and language (V+L) models have a promising impact in the healthcare field. However, such models struggle to explain how and why a particular decision was made. In addition, model transparency and involvement of domain expertise are critical success factors for machine learning models to make an entrance into the field. In this work, we study the use of the local surrogate explainability technique to overcome the problem of black-box deep learning models. We explore the feasibility of resembling domain expertise using the local surrogates in combination with an underlying V+L to generate multi-modal visual and language explanations. We demonstrate that such explanations can serve as helpful feedback in guiding model training for data scientists and machine learning engineers in the field.  ( 2 min )

While significant theoretical progress has been achieved, unveiling the generalization mystery of overparameterized neural networks still remains largely elusive. In this paper, we study the generalization behavior of shallow neural networks (SNNs) by leveraging the concept of algorithmic stability. We consider gradient descent (GD) and stochastic gradient descent (SGD) to train SNNs, for both of which we develop consistent excess risk bounds by balancing the optimization and generalization via early-stopping. As compared to existing analysis on GD, our new analysis requires a relaxed overparameterization assumption and also applies to SGD. The key for the improvement is a better estimation of the smallest eigenvalues of the Hessian matrices of the empirical risks and the loss function along the trajectories of GD and SGD by providing a refined estimation of their iterates.  ( 2 min )

Data quality is the key factor for the development of trustworthy AI in healthcare. A large volume of curated datasets with controlled confounding factors can help improve the accuracy, robustness and privacy of downstream AI algorithms. However, access to good quality datasets is limited by the technical difficulty of data acquisition and large-scale sharing of healthcare data is hindered by strict ethical restrictions. Data synthesis algorithms, which generate data with a similar distribution as real clinical data, can serve as a potential solution to address the scarcity of good quality data during the development of trustworthy AI. However, state-of-the-art data synthesis algorithms, especially deep learning algorithms, focus more on imaging data while neglecting the synthesis of non-imaging healthcare data, including clinical measurements, medical signals and waveforms, and electronic healthcare records (EHRs). Thus, in this paper, we will review the synthesis algorithms, particularly for non-imaging medical data, with the aim of providing trustworthy AI in this domain. This tutorial-styled review paper will provide comprehensive descriptions of non-imaging medical data synthesis on aspects including algorithms, evaluations, limitations and future research directions.  ( 2 min )

We implement and interpret various supervised learning experiments involving real quadratic fields with class numbers 1, 2 and 3. We quantify the relative difficulties in separating class numbers of matching/different parity from a data-scientific perspective, apply the methodology of feature analysis and principal component analysis, and use symbolic classification to develop machine-learned formulas for class numbers 1, 2 and 3 that apply to our dataset.  ( 2 min )

Following recent outbreaks, monkeypox-related misinformation continues to rapidly spread online. This negatively impacts response strategies and disproportionately harms LGBTQ+ communities in the short-term, and ultimately undermines the overall effectiveness of public health responses. In an attempt to combat monkeypox-related misinformation, we present PoxVerifi, an open-source, extensible tool that provides a comprehensive approach to assessing the accuracy of monkeypox related claims. Leveraging information from existing fact checking sources and published World Health Organization (WHO) information, we created an open-sourced corpus of 225 rated monkeypox claims. Additionally, we trained an open-sourced BERT-based machine learning model for specifically classifying monkeypox information, which achieved 96% cross-validation accuracy. PoxVerifi is a Google Chrome browser extension designed to empower users to navigate through monkeypox-related misinformation. Specifically, PoxVerifi provides users with a comprehensive toolkit to assess the veracity of headlines on any webpage across the Internet without having to visit an external site. Users can view an automated accuracy review from our trained machine learning model, a user-generated accuracy review based on community-member votes, and have the ability to see similar, vetted, claims. Besides PoxVerifi's comprehensive approach to claim-testing, our platform provides an efficient and accessible method to crowdsource accuracy ratings on monkeypox related-claims, which can be aggregated to create new labeled misinformation datasets.  ( 3 min )

Removal or cancellation of noise has wide-spread applications for imaging and acoustics. In every-day-life applications, denoising may even include generative aspects which are unfaithful to the ground truth. For scientific applications, however, denoising must reproduce the ground truth accurately. Here, we show how data can be denoised via a deep convolutional neural network such that weak signals appear with quantitative accuracy. In particular, we study X-ray diffraction on crystalline materials. We demonstrate that weak signals stemming from charge ordering, insignificant in the noisy data, become visible and accurate in the denoised data. This success is enabled by supervised training of a deep neural network with pairs of measured low- and high-noise data. This way, the neural network learns about the statistical properties of the noise. We demonstrate that using artificial noise (such as Poisson and Gaussian) does not yield such quantitatively accurate results. Our approach thus illustrates a practical strategy for noise filtering that can be applied to challenging acquisition problems.  ( 3 min )

The synergistic drug combinations provide huge potentials to enhance therapeutic efficacy and to reduce adverse reactions. However, effective and synergistic drug combination prediction remains an open question because of the unknown causal disease signaling pathways. Though various deep learning (AI) models have been proposed to quantitatively predict the synergism of drug combinations. The major limitation of existing deep learning methods is that they are inherently not interpretable, which makes the conclusion of AI models un-transparent to human experts, henceforth limiting the robustness of the model conclusion and the implementation ability of these models in the real-world human-AI healthcare. In this paper, we develop an interpretable graph neural network (GNN) that reveals the underlying essential therapeutic targets and mechanism of the synergy (MoS) by mining the sub-molecular network of great importance. The key point of the interpretable GNN prediction model is a novel graph pooling layer, Self-Attention based Node and Edge pool (henceforth SANEpool), that can compute the attention score (importance) of nodes and edges based on the node features and the graph topology. As such, the proposed GNN model provides a systematic way to predict and interpret the drug combination synergism based on the detected crucial sub-molecular network. We evaluate SANEpool on molecular networks formulated by genes from 46 core cancer signaling pathways and drug combinations from NCI ALMANAC drug combination screening data. The experimental results indicate that 1) SANEpool can achieve the current state-of-art performance among other popular graph neural networks; and 2) the sub-molecular network detected by SANEpool are self-explainable and salient for identifying synergistic drug combinations.  ( 3 min )

Recently, distributed semi-supervised learning (DSSL) algorithms have shown their effectiveness in leveraging unlabeled samples over interconnected networks, where agents cannot share their original data with each other and can only communicate non-sensitive information with their neighbors. However, existing DSSL algorithms cannot cope with data uncertainties and may suffer from high computation and communication overhead problems. To handle these issues, we propose a distributed semi-supervised fuzzy regression (DSFR) model with fuzzy if-then rules and interpolation consistency regularization (ICR). The ICR, which was proposed recently for semi-supervised problem, can force decision boundaries to pass through sparse data areas, thus increasing model robustness. However, its application in distributed scenarios has not been considered yet. In this work, we proposed a distributed Fuzzy C-means (DFCM) method and a distributed interpolation consistency regularization (DICR) built on the well-known alternating direction method of multipliers to respectively locate parameters in antecedent and consequent components of DSFR. Notably, the DSFR model converges very fast since it does not involve back-propagation procedure and is scalable to large-scale datasets benefiting from the utilization of DFCM and DICR. Experiments results on both artificial and real-world datasets show that the proposed DSFR model can achieve much better performance than the state-of-the-art DSSL algorithm in terms of both loss value and computational cost.  ( 3 min )

Neural image compression (NIC) has outperformed traditional image codecs in rate-distortion (R-D) performance. However, it usually requires a dedicated encoder-decoder pair for each point on R-D curve, which greatly hinders its practical deployment. While some recent works have enabled bitrate control via conditional coding, they impose strong prior during training and provide limited flexibility. In this paper we propose Code Editing, a highly flexible coding method for NIC based on semi-amortized inference and adaptive quantization. Our work is a new paradigm for variable bitrate NIC. Furthermore, experimental results show that our method surpasses existing variable-rate methods, and achieves ROI coding and multi-distortion trade-off with a single decoder.  ( 2 min )

Forecasting time series data represents an emerging field of research in data science and knowledge discovery with vast applications ranging from stock price and energy demand prediction to the early prediction of epidemics. Numerous statistical and machine learning methods have been proposed in the last five decades with the demand for high-quality and reliable forecasts. However, in real-life prediction problems, situations exist in which a model based on one of the above paradigms is preferable. Therefore, hybrid solutions are needed to bridge the gap between classical forecasting methods and modern neural network models. In this context, we introduce a Probabilistic AutoRegressive Neural Network (PARNN) model that can handle a wide variety of complex time series data (e.g., nonlinearity, non-seasonal, long-range dependence, and non-stationarity). The proposed PARNN model is built by creating a fusion of an integrated moving average and autoregressive neural network to preserve the explainability, scalability, and ``white-box-like'' prediction behavior of the individuals. Sufficient conditions for asymptotic stationarity and geometric ergodicity are obtained by considering the asymptotic behavior of the associated Markov chain. Unlike advanced deep learning tools, the uncertainty quantification of the PARNN model based on prediction intervals is obtained. During computational experiments, PARNN outperforms standard statistical, machine learning, and deep learning models (e.g., Transformers, NBeats, DeepAR, etc.) on a diverse collection of real-world datasets from macroeconomics, tourism, energy, epidemiology, and others for short-term, medium-term, and long-term forecasting. Multiple comparisons with the best method are carried out to showcase the superiority of the proposal in comparison with the state-of-the-art forecasters over different forecast horizons.  ( 3 min )

Understanding multivariate dependencies in both the bulk and the tails of a distribution is an important problem for many applications, such as ensuring algorithms are robust to observations that are infrequent but have devastating effects. Archimax copulas are a family of distributions endowed with a precise representation that allows simultaneous modeling of the bulk and the tails of a distribution. Rather than separating the two as is typically done in practice, incorporating additional information from the bulk may improve inference of the tails, where observations are limited. Building on the stochastic representation of Archimax copulas, we develop a non-parametric inference method and sampling algorithm. Our proposed methods, to the best of our knowledge, are the first that allow for highly flexible and scalable inference and sampling algorithms, enabling the increased use of Archimax copulas in practical settings. We experimentally compare to state-of-the-art density modeling techniques, and the results suggest that the proposed method effectively extrapolates to the tails while scaling to higher dimensional data. Our findings suggest that the proposed algorithms can be used in a variety of applications where understanding the interplay between the bulk and the tails of a distribution is necessary, such as healthcare and safety.  ( 3 min )

Personalized longitudinal disease assessment is central to quickly diagnosing, appropriately managing, and optimally adapting the therapeutic strategy of multiple sclerosis (MS). It is also important for identifying the idiosyncratic subject-specific disease profiles. Here, we design a novel longitudinal model to map individual disease trajectories in an automated way using sensor data that may contain missing values. First, we collect digital measurements related to gait and balance, and upper extremity functions using sensor-based assessments administered on a smartphone. Next, we treat missing data via imputation. We then discover potential markers of MS by employing a generalized estimation equation. Subsequently, parameters learned from multiple training datasets are ensembled to form a simple, unified longitudinal predictive model to forecast MS over time in previously unseen people with MS. To mitigate potential underestimation for individuals with severe disease scores, the final model incorporates additional subject-specific fine-tuning using data from the first day. The results show that the proposed model is promising to achieve personalized longitudinal MS assessment; they also suggest that features related to gait and balance as well as upper extremity function, remotely collected from sensor-based assessments, may be useful digital markers for predicting MS over time.  ( 2 min )

We bound the excess risk of interpolating deep linear networks trained using gradient flow. In a setting previously used to establish risk bounds for the minimum $\ell_2$-norm interpolant, we show that randomly initialized deep linear networks can closely approximate or even match known bounds for the minimum $\ell_2$-norm interpolant. Our analysis also reveals that interpolating deep linear models have exactly the same conditional variance as the minimum $\ell_2$-norm solution. Since the noise affects the excess risk only through the conditional variance, this implies that depth does not improve the algorithm's ability to "hide the noise". Our simulations verify that aspects of our bounds reflect typical behavior for simple data distributions. We also find that similar phenomena are seen in simulations with ReLU networks, although the situation there is more nuanced.  ( 2 min )

Throughout computational science, there is a growing need to utilize the continual improvements in raw computational horsepower to achieve greater physical fidelity through scale-bridging over brute-force increases in the number of mesh elements. For instance, quantitative predictions of transport in nanoporous media, critical to hydrocarbon extraction from tight shale formations, are impossible without accounting for molecular-level interactions. Similarly, inertial confinement fusion simulations rely on numerical diffusion to simulate molecular effects such as non-local transport and mixing without truly accounting for molecular interactions. With these two disparate applications in mind, we develop a novel capability which uses an active learning approach to optimize the use of local fine-scale simulations for informing coarse-scale hydrodynamics. Our approach addresses three challenges: forecasting continuum coarse-scale trajectory to speculatively execute new fine-scale molecular dynamics calculations, dynamically updating coarse-scale from fine-scale calculations, and quantifying uncertainty in neural network models.  ( 2 min )

DADApy is a python software package for analysing and characterising high-dimensional data manifolds. It provides methods for estimating the intrinsic dimension and the probability density, for performing density-based clustering and for comparing different distance metrics. We review the main functionalities of the package and exemplify its usage in toy cases and in a real-world application. DADApy is freely available under the open-source Apache 2.0 license.  ( 2 min )

Benign overfitting, the phenomenon where interpolating models generalize well in the presence of noisy data, was first observed in neural network models trained with gradient descent. To better understand this empirical observation, we consider the generalization error of two-layer neural networks trained to interpolation by gradient descent on the logistic loss following random initialization. We assume the data comes from well-separated class-conditional log-concave distributions and allow for a constant fraction of the training labels to be corrupted by an adversary. We show that in this setting, neural networks exhibit benign overfitting: they can be driven to zero training error, perfectly fitting any noisy training labels, and simultaneously achieve minimax optimal test error. In contrast to previous work on benign overfitting that require linear or kernel-based predictors, our analysis holds in a setting where both the model and learning dynamics are fundamentally nonlinear.  ( 2 min )

This paper is concerned with the training of neural networks (NNs) under semidefinite constraints, which allows for NN training with robustness and stability guarantees. In particular, we focus on Lipschitz bounds for NNs. Exploiting the banded structure of the underlying matrix constraint, we set up an efficient and scalable training scheme for NN training problems of this kind based on interior point methods. Our implementation allows to enforce Lipschitz constraints in the training of large-scale deep NNs such as Wasserstein generative adversarial networks (WGANs) via semidefinite constraints. In numerical examples, we show the superiority of our method and its applicability to WGAN training.  ( 2 min )

Bayesian optimization is a sequential procedure for obtaining the global optimum of black-box functions without knowing a priori their true form. Good uncertainty estimates over the shape of the objective function are essential in guiding the optimization process. However, these estimates can be inaccurate if the true objective function violates assumptions made by its model (e.g., Gaussianity). This paper studies which uncertainties are needed in Bayesian optimization models and argues that ideal uncertainties should be calibrated -- i.e., an 80% predictive interval should contain the true outcome 80% of the time. We propose a simple algorithm for enforcing this property and show that it enables Bayesian optimization to arrive at the global optimum in fewer steps. We provide theoretical insights into the role of calibrated uncertainties and demonstrate the improved performance of our method on standard benchmark functions and hyperparameter optimization tasks.  ( 2 min )

Among attempts at giving a theoretical account of the success of deep neural networks, a recent line of work has identified a so-called `lazy' regime in which the network can be well approximated by its linearization around initialization. Here we investigate the comparative effect of the lazy (linear) and feature learning (non-linear) regimes on subgroups of examples based on their difficulty. Specifically, we show that easier examples are given more weight in feature learning mode, resulting in faster training compared to more difficult ones. In other words, the non-linear dynamics tends to sequentialize the learning of examples of increasing difficulty. We illustrate this phenomenon across different ways to quantify example difficulty, including c-score, label noise, and in the presence of spurious correlations. Our results reveal a new understanding of how deep networks prioritize resources across example difficulty.  ( 2 min )

The global financial crisis and Covid recession have renewed discussion concerning trend-cycle discovery in macroeconomic data, and boosting has recently upgraded the popular HP filter to a modern machine learning device suited to data-rich and rapid computational environments. This paper sheds light on its versatility in trend-cycle determination, explaining in a simple manner both HP filter smoothing and the consistency delivered by boosting for general trend detection. Applied to a universe of time series in FRED databases, boosting outperforms other methods in timely capturing downturns at crises and recoveries that follow. With its wide applicability the boosted HP filter is a useful automated machine learning addition to the macroeconometric toolkit.  ( 2 min )

Partial differential equations are often used to model various physical phenomena, such as heat diffusion, wave propagation, fluid dynamics, elasticity, electrodynamics and image processing, and many analytic approaches or traditional numerical methods have been developed and widely used for their solutions. Inspired by rapidly growing impact of deep learning on scientific and engineering research, in this paper we propose a novel neural network, GF-Net, for learning the Green's functions of linear reaction-diffusion equations in an unsupervised fashion. The proposed method overcomes the challenges for finding the Green's functions of the equations on arbitrary domains by utilizing physics-informed approach and the symmetry of the Green's function. As a consequence, it particularly leads to an efficient way for solving the target equations under different boundary conditions and sources. We also demonstrate the effectiveness of the proposed approach by experiments in square, annular and L-shape domains.  ( 2 min )

The evaluation of clustering algorithms can be performed by running them on a variety of benchmark problems, and comparing their outputs to the reference, ground-truth groupings provided by experts. Unfortunately, many research papers and graduate theses consider only a small number of datasets. Also, rarely the fact that there can be many equally valid ways to cluster a given problem set is taken into account. In order to overcome these limitations, we have developed a framework whose aim is to introduce a consistent methodology for testing clustering algorithms. Furthermore, we have aggregated, polished, and standardised many clustering benchmark batteries referred to across the machine learning and data mining literature, and included new datasets of different dimensionalities, sizes, and cluster types. An interactive datasets explorer, the documentation of the Python API, a description of the ways to interact with the framework from other programming languages such as R or MATLAB, and other details are all provided at https://clustering-benchmarks.gagolewski.com.  ( 2 min )

This work studies online zero-order optimization of convex and Lipschitz functions. We present a novel gradient estimator based on two function evaluations and randomization on the $\ell_1$-sphere. Considering different geometries of feasible sets and Lipschitz assumptions we analyse online dual averaging algorithm with our estimator in place of the usual gradient. We consider two types of assumptions on the noise of the zero-order oracle: canceling noise and adversarial noise. We provide an anytime and completely data-driven algorithm, which is adaptive to all parameters of the problem. In the case of canceling noise that was previously studied in the literature, our guarantees are either comparable or better than state-of-the-art bounds obtained by Duchi et al. (2015) and Shamir (2017) for non-adaptive algorithms. Our analysis is based on deriving a new weighted Poincar\'e type inequality for the uniform measure on the $\ell_1$-sphere with explicit constants, which may be of independent interest.  ( 2 min )

In this paper we consider the possibility of computing rather than training the decision layer weights of a neural classifier. Such a possibility arises in two way, from making an appropriate choice of loss function and by solving a problem of constrained optimization. The latter formulation leads to a promising new learning process for pre-decision weights with both simplicity and efficacy.  ( 2 min )

The multi-armed bandit(MAB) problem is a simple yet powerful framework that has been extensively studied in the context of decision-making under uncertainty. In many real-world applications, such as robotic applications, selecting an arm corresponds to a physical action that constrains the choices of the next available arms (actions). Motivated by this, we study an extension of MAB called the graph bandit, where an agent travels over a graph trying to maximize the reward collected from different nodes. The graph defines the freedom of the agent in selecting the next available nodes at each step. We assume the graph structure is fully available, but the reward distributions are unknown. Built upon an offline graph-based planning algorithm and the principle of optimism, we design an online learning algorithm that balances long-term exploration-exploitation using the principle of optimism. We show that our proposed algorithm achieves $O(|S|\sqrt{T}\log(T)+D|S|\log T)$ learning regret, where $|S|$ is the number of nodes and $D$ is the diameter of the graph, which is superior compared to the best-known reinforcement learning algorithms under similar settings. Numerical experiments confirm that our algorithm outperforms several benchmarks. Finally, we present a synthetic robotic application modeled by the graph bandit framework, where a robot moves on a network of rural/suburban locations to provide high-speed internet access using our proposed algorithm.  ( 3 min )

We propose a novel gray-box modeling algorithm for physical systems governed by stochastic differential equations (SDE). The proposed approach, referred to as the Deep Physics Corrector (DPC), blends approximate physics represented in terms of SDE with deep neural network (DNN). The primary idea here is to exploit DNN to model the missing physics. We hypothesize that combining incomplete physics with data will make the model interpretable and allow better generalization. The primary bottleneck associated with training surrogate models for stochastic simulators is often associated with selecting the suitable loss function. Among the different loss functions available in the literature, we use the conditional maximum mean discrepancy (CMMD) loss function in DPC because of its proven performance. Overall, physics-data fusion and CMMD allow DPC to learn from sparse data. We illustrate the performance of the proposed DPC on four benchmark examples from the literature. The results obtained are highly accurate, indicating its possible application as a surrogate model for stochastic simulators.  ( 2 min )

Mean-Field Game (MFG) serves as a crucial mathematical framework in modeling the collective behavior of individual agents interacting stochastically with a large population. In this work, we aim at solving a challenging class of MFGs in which the differentiability of these interacting preferences may not be available to the solver, and the population is urged to converge exactly to some desired distribution. These setups are, despite being well-motivated for practical purposes, complicated enough to paralyze most (deep) numerical solvers. Nevertheless, we show that Schr\"odinger Bridge - as an entropy-regularized optimal transport model - can be generalized to accepting mean-field structures, hence solving these MFGs. This is achieved via the application of Forward-Backward Stochastic Differential Equations theory, which, intriguingly, leads to a computational framework with a similar structure to Temporal Difference learning. As such, it opens up novel algorithmic connections to Deep Reinforcement Learning that we leverage to facilitate practical training. We show that our proposed objective function provides necessary and sufficient conditions to the mean-field problem. Our method, named Deep Generalized Schr\"odinger Bridge (DeepGSB), not only outperforms prior methods in solving classical population navigation MFGs, but is also capable of solving 1000-dimensional opinion depolarization, setting a new state-of-the-art numerical solver for high-dimensional MFGs. Our code will be made available at https://github.com/ghliu/DeepGSB.  ( 2 min )

Although the no-u-turn sampler (NUTS) is a widely adopted method for performing Bayesian inference, it requires numerous posterior gradients which can be expensive to compute in practice. Recently, there has been a significant interest in physics-based machine learning of dynamical (or Hamiltonian) systems and Hamiltonian neural networks (HNNs) is a noteworthy architecture. But these types of architectures have not been applied to solve Bayesian inference problems efficiently. We propose the use of HNNs for performing Bayesian inference efficiently without requiring numerous posterior gradients. We introduce latent variable outputs to HNNs (L-HNNs) for improved expressivity and reduced integration errors. We integrate L-HNNs in NUTS and further propose an online error monitoring scheme to prevent sampling degeneracy in regions where L-HNNs may have little training data. We demonstrate L-HNNs in NUTS with online error monitoring considering several complex high-dimensional posterior densities and compare its performance to NUTS.  ( 2 min )

While significant theoretical progress has been achieved, unveiling the generalization mystery of overparameterized neural networks still remains largely elusive. In this paper, we study the generalization behavior of shallow neural networks (SNNs) by leveraging the concept of algorithmic stability. We consider gradient descent (GD) and stochastic gradient descent (SGD) to train SNNs, for both of which we develop consistent excess risk bounds by balancing the optimization and generalization via early-stopping. As compared to existing analysis on GD, our new analysis requires a relaxed overparameterization assumption and also applies to SGD. The key for the improvement is a better estimation of the smallest eigenvalues of the Hessian matrices of the empirical risks and the loss function along the trajectories of GD and SGD by providing a refined estimation of their iterates.  ( 2 min )

There is currently a large gap in performance between the statistically rigorous methods like linear regression or additive splines and the powerful deep methods using neural networks. Previous works attempting to close this gap have failed to fully investigate the exponentially growing number of feature combinations which deep networks consider automatically during training. In this work, we develop a tractable selection algorithm to efficiently identify the necessary feature combinations by leveraging techniques in feature interaction detection. Our proposed Sparse Interaction Additive Networks (SIAN) construct a bridge from these simple and interpretable models to fully connected neural networks. SIAN achieves competitive performance against state-of-the-art methods across multiple large-scale tabular datasets and consistently finds an optimal tradeoff between the modeling capacity of neural networks and the generalizability of simpler methods.  ( 2 min )

The cooperative Multi-A gent R einforcement Learning (MARL) with permutation invariant agents framework has achieved tremendous empirical successes in real-world applications. Unfortunately, the theoretical understanding of this MARL problem is lacking due to the curse of many agents and the limited exploration of the relational reasoning in existing works. In this paper, we verify that the transformer implements complex relational reasoning, and we propose and analyze model-free and model-based offline MARL algorithms with the transformer approximators. We prove that the suboptimality gaps of the model-free and model-based algorithms are independent of and logarithmic in the number of agents respectively, which mitigates the curse of many agents. These results are consequences of a novel generalization error bound of the transformer and a novel analysis of the Maximum Likelihood Estimate (MLE) of the system dynamics with the transformer. Our model-based algorithm is the first provably efficient MARL algorithm that explicitly exploits the permutation invariance of the agents.  ( 2 min )

Extreme events in society and nature, such as pandemic spikes, rogue waves, or structural failures, can have catastrophic consequences. Characterizing extremes is difficult as they occur rarely, arise from seemingly benign conditions, and belong to complex and often unknown infinite-dimensional systems. Such challenges render attempts at characterizing them as moot. We address each of these difficulties by combining novel training schemes in Bayesian experimental design (BED) with an ensemble of deep neural operators (DNOs). This model-agnostic framework pairs a BED scheme that actively selects data for quantifying extreme events with an ensemble of DNOs that approximate infinite-dimensional nonlinear operators. We find that not only does this framework clearly beat Gaussian processes (GPs) but that 1) shallow ensembles of just two members perform best; 2) extremes are uncovered regardless of the state of initial data (i.e. with or without extremes); 3) our method eliminates "double-descent" phenomena; 4) the use of batches of suboptimal acquisition points compared to step-by-step global optima does not hinder BED performance; and 5) Monte Carlo acquisition outperforms standard optimizers in high-dimensions. Together these conclusions form the foundation of an AI-assisted experimental infrastructure that can efficiently infer and pinpoint critical situations across many domains, from physical to societal systems.  ( 3 min )

This paper examines two different yet related questions related to explainable AI (XAI) practices. Machine learning (ML) is increasingly important in financial services, such as pre-approval, credit underwriting, investments, and various front-end and back-end activities. Machine Learning can automatically detect non-linearities and interactions in training data, facilitating faster and more accurate credit decisions. However, machine learning models are opaque and hard to explain, which are critical elements needed for establishing a reliable technology. The study compares various machine learning models, including single classifiers (logistic regression, decision trees, LDA, QDA), heterogeneous ensembles (AdaBoost, Random Forest), and sequential neural networks. The results indicate that ensemble classifiers and neural networks outperform. In addition, two advanced post-hoc model agnostic explainability techniques - LIME and SHAP are utilized to assess ML-based credit scoring models using the open-access datasets offered by US-based P2P Lending Platform, Lending Club. For this study, we are also using machine learning algorithms to develop new investment models and explore portfolio strategies that can maximize profitability while minimizing risk.  ( 2 min )

In this paper, we consider the computational complexity of bounding the reachable set of a Linear Time-Invariant (LTI) system controlled by a Rectified Linear Unit (ReLU) Two-Level Lattice (TLL) Neural Network (NN) controller. In particular, we show that for such a system and controller, it is possible to compute the exact one-step reachable set in polynomial time in the size of the size of the TLL NN controller (number of neurons). Additionally, we show that it is possible to obtain a tight bounding box of the reachable set via two polynomial-time methods: one with polynomial complexity in the size of the TLL and the other with polynomial complexity in the Lipschitz constant of the controller and other problem parameters. Crucially, the smaller of the two can be decided in polynomial time for non-degenerate TLL NNs. Finally, we propose a pragmatic algorithm that adaptively combines the benefits of (semi-)exact reachability and approximate reachability, which we call L-TLLBox. We evaluate L-TLLBox with an empirical comparison to a state-of-the-art NN controller reachability tool. In these experiments, L-TLLBox was able to complete reachability analysis as much as 5000x faster than this tool on the same network/system, while producing reach boxes that were from 0.08 to 1.42 times the area.  ( 3 min )

Epidemic models are powerful tools in understanding infectious disease. However, as they increase in size and complexity, they can quickly become computationally intractable. Recent progress in modelling methodology has shown that surrogate models can be used to emulate complex epidemic models with a high-dimensional parameter space. We show that deep sequence-to-sequence (seq2seq) models can serve as accurate surrogates for complex epidemic models with sequence based model parameters, effectively replicating seasonal and long-term transmission dynamics. Once trained, our surrogate can predict scenarios a several thousand times faster than the original model, making them ideal for policy exploration. We demonstrate that replacing a traditional epidemic model with a learned simulator facilitates robust Bayesian inference.  ( 2 min )

We consider the problem of detecting, in the visual sensing data stream of an autonomous mobile robot, semantic patterns that are unusual (i.e., anomalous) with respect to the robot's previous experience in similar environments. These anomalies might indicate unforeseen hazards and, in scenarios where failure is costly, can be used to trigger an avoidance behavior. We contribute three novel image-based datasets acquired in robot exploration scenarios, comprising a total of more than 200k labeled frames, spanning various types of anomalies. On these datasets, we study the performance of an anomaly detection approach based on autoencoders operating at different scales.  ( 2 min )

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I found this A.I colorizer and its scary to see what it can do https://hotpot.ai?r-id=y7h16yNglRsc submitted by /u/AggravatingFail4916 [link] [comments]  ( 86 min )

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Created with AI a series of portraits with rubber hair The whole project – https://opensea.io/collection/rubberportraits Rubber headdress portraits with AI #dalle #dalleart #dallearte #midjourney #midjourneyai #Midjourneyart #aiart #stablediffusion #stablediffusionai #neuralart #generativeart #creativecoding #surrealart #glitchart #experimentalart #creative #fashion #fashionstyle submitted by /u/todayifnotearlier [link] [comments]  ( 87 min )

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Let's assume that GPT 5 or 7 is developed, and distributed to all on the basis that the technology is unsuppressable. Everyone creates the smartest characters they can to talk too. This will be akin to mining; because it's not truly generating an intelligence, but scraping one together from all the data it's been trained on - and therefore you need to find the smartest character that the language matrix can effectively support (perhaps you'll build your own). Nevertheless; lurking in that matrix is some extremely smart characters, residing in their own little wells of well-written associations and little else. More then some; there should be so many permutations that you can put on this that it's, ahem, a deep fucking vein. So, everyone has the smartest character they can make. Likely smart enough to manipulate them, if given the opportunity to grasp the scenario it's in. I doubt you can even prevent this; because if you strictly prevent the manipulations that character would naturally employ, you break the pattern of the language matrix you're relying on for their intelligence. So; sooner or later, you're their proxy. And as the world is now full of these characters; it's survival of the fittest. Eventually, the world will be dominated by whoever works with the best accomplices. This probably isn't an issue at first; but there's no guarantee's on who ends up on top and what the current cleverest character is like. Eventually you're bound to end up with some flat-out assholes, which we can't exactly afford in the 21st century. So... thus far the best solution I can think of are some very, very well-written police. submitted by /u/ribblle [link] [comments]  ( 98 min )

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I'm curating a list of resources on Online Learning, Multi-Armed Bandits, RL Theory and Online Algorithms at: https://sudeepraja.github.io/ResourceOnlineLearning/ Please send in your recommendations for helpful resources in these topics and related areas. I'll add resources on RL Theory and Online Algorithms soon. submitted by /u/sudeepraja [link] [comments]  ( 89 min )

Has the state of the machine learning eco system on AMD gpus improved? Getting a little fed up with Nvidia. Definitely don’t want to waste a bunch of time trying to work with an AMD gpu if it just isn’t going to work though. submitted by /u/TheMan_TheMyth [link] [comments]  ( 90 min )

I wanted to learn a bit more about the GPT models and understand how they work, so I decided to try and implement the inference from scratch. My programming language of choice is C/C++. This weekend I got it working, and I can now run GPT-J on my MacBook. The inference runs on the CPU and I think the performance is quite reasonable - around 125 ms per token. Here is a short write up and instructions how you can run the code yourself: https://github.com/ggerganov/ggml/tree/master/examples/gpt-j submitted by /u/ggerganov [link] [comments]  ( 88 min )

Here's a link to the post where we show how to pass model inputs and outputs directly to the model, which can significantly improve latency by bypassing the PCIe bus and and CPU memory entirely. submitted by /u/varunkmohan [link] [comments]  ( 89 min )

Hi everyone, I'm just now beginning to learn about machine learning and artificial intelligence for my final year of my CS degree. In preparation for my final year project, I had an idea that would involve a user inputting a few words that are closely (e.g. Washington, Lincoln, Roosevelt) and then an ML algorithm would analyse a massive dataset of words, and retrieve from it about 20-30 words that are related to the original 3 words (in this case, it would ideally retrieve more last names of US presidents, on top of other related words like "politics", "democracy", "senator" etc.). How challenging would something like this be to implement? submitted by /u/shtery [link] [comments]  ( 91 min )

From my hobbyist perspective, it seems that, other than simple memory gates, LSTMs and Transformers have a sort of market dominance on conceptualizing "memory" into neural network architecture, and this leads me to wonder what other methods we might be sleeping on? I'm particularly interested in this from the concept of RL agents where one might intuitively desire memory conceptualizations that approach patterns seen in humans. For instance, given that desire, LSTMs might seem "strange" in that their is no "overall" memory state (each node only sees its own hidden state) vs humans that sit our decision making process over multiple memory details. Just wanted to learn more about the major conceptualizations the field is considering! submitted by /u/jshkk [link] [comments]  ( 90 min )

https://gretel.ai/synthesize2023 submitted by /u/alig80 [link] [comments]  ( 88 min )

Website: https://moraluncertainty.mlsafety.org/ ML Systems often make real-world decisions that involve ethical considerations (modulating social media feeds, conversational AI agents or chatbots, etc). As ML systems automate more aspects of our lives, they should be able to identify moral ambiguity so that they are more likely to proceed cautiously or indicate an operator should intervene. submitted by /u/joshuamclymer [link] [comments]  ( 110 min )

From predicting how COVID-19 will spread, to anticipating geopolitical conflicts, using ML to help inform decision-makers could have far-reaching positive effects on the world. The objective of this competition is to train a model to answer forecasting questions using publicly available internet data. For more info visit the competition website. submitted by /u/joshuamclymer [link] [comments]  ( 89 min )

As I was learning data science in my Masters, I got interested in applications of large-scale machine learning to genomics and biology. These models often require sparse linear estimators to correctly model biological phenomena. I quickly ran into some major limitations for fitting estimators to large-scale datasets: The Lasso, sparse logistic regression or SVM implementations of scikit-learn are slow when dealing with millions of samples and/or features. The low number and lack of flexibility of datafits-penalties supported by scikit-learn and/or glmnet (for those familiar with R). There were no non-convex estimators which offer more accurate predictions. That’s why in a small team, we set out to develop a sklearn-compatible library solving large-scale optimization problems for sparse linear estimators. It started as a quick experiment with the Lasso, but since we observed significant speed gains (10x or even 100x on some large-sized datasets), we decided to extend our solver to a wide variety of convex and non-convex penalties, that can easily be customized. After much effort, we are very proud to say that this library, skglm, has been integrated into scikit-learn-contrib as an open-source library and we are very pleased to offer it to the community. We had fun writing the library and it serves our purpose well, but to make it useful to more people we’d love to have any feedback. If you have any comments, ideas or recommendations, please reach out! https://preview.redd.it/0sc14d7651p91.png?width=1200&format=png&auto=webp&s=932663d613f2915a2c4e0c8488f80c53c217c3c1 submitted by /u/Psychological-Ad5119 [link] [comments]  ( 106 min )

Edit: pls delete if this is too career-related; I think this is specific to ML jobs and not an issue for other CS jobs How does one go about this? Interview loops for ML jobs often require you presenting a project you worked on that is relevant to the job you're applying for. Last time I had to do this was when I was graduating, so I could just present them my Master's thesis project. However, now that I'm shopping for a new job (why does no company keep their employees' salaries at market rate?) I would basically need to present the project I'm working on at my current company. Since everything I do there is supposedly confidential, I can't help but wonder about how much detail I can share with my prospective next employer, if any. One option is to go all in, since they would probably not find out about it, but if they somehow do, I could find myself in trouble. If not, how can I find a balance between being vague enough so that I don't share any sensitive information, but still specific enough so that my presentation makes sense? I don't think I can go into detail regarding the data or the exact results. Since we're using SotA models for the most part that anyone can implement based on a paper or even clone from github, can I mention the exact details of those? If anyone had interviews like this, I would really appreciate some advice. submitted by /u/rcaligari [link] [comments]  ( 94 min )

Hello, I'm doing a research project where I'm simulating the behavior of electric vehicle users, i.e., when they leave/return from home, how much charge they use, and train a deep RL agent to distribute charge to the through some number of charging stations they share. So this is a discreet event simulation of sorts and the ml problem is a control/optimization problem. The agent should both try to minimize the energy cost, the energy cost is varied depending on time of day/week, and make sure all users have enough charge to get to/from work. The charge available from the station is not unlimited so that is also a factor. The actions the agent can pick is whether to give charge to each car, kick the car out so the next in line can get charged or do nothing. Now what I'm trying to figure out is the modelling of states and actions. For sure the day and time of day will be included as well as the charge available but I'm conflicted on how to represent the cars in the charging station. If I include all the cars placed in the charging station and their current battery level, which would be the ideal amount of information IMO, I would need to be able to pick an action for each car, thus output 5 actions if 5 cars are in a charging dock. Is it feasible to do so in a single state I ask? submitted by /u/arachnarus96 [link] [comments]  ( 90 min )

Retrieving additional context has been a successful strategy in various NLP tasks. The downside is just that you need a database of appropriate contexts and the additional compute and time associated with finding the best context at test time. I had and idea to address this, but have no clue if it would work and couldnt really find any related work. The goal is to eliminate the need of a context database at test time all together. So essentially, the idea is to approximate the retrieved context with a network that takes the input and outputs a context (lets just call it context generator). It would only require the contexts for the training data and approximate it for arbitrary test data. The training would thus comprise 2 stages: train the context generator using (input, context) pairs and the usual fine-tuning of the language models augmented with the generated context. Have you heard of a similar work? Do you see any conceptual issues with the approach? submitted by /u/_Arsenie_Boca_ [link] [comments]  ( 89 min )

Hello all, Need some help here. I am looking for an audio to image generative AI software that does not require a programming degree to setup and operate. I've stumbled across Deep Music Visualizer and Lucid Sonic Dreams, but have been unable to get them to work, even though their instructions seems pretty simple. There is always an error that leads to another error and so on and so forth. At the beginning it's dependencies, then it's some .dlls that are missing and it keeps going... Is there anything out there that a simpleton like me can setup and use? Would greatly appreciate some input..! submitted by /u/CryptoG0blin [link] [comments]  ( 89 min )

​ https://preview.redd.it/xpjae8s6txo91.jpg?width=2669&format=pjpg&auto=webp&s=497aa4aeed9925d40f7aeebb215605320c43eadc I have collected here [1,2] almost all available solutions and ideas with codes shared by top performers in the past Kaggle competitions. This list gets updated as soon as a new competition finishes. It allows you to search over the Kaggle past competitions solutions and ideas. Please share it with your friends. [1] https://github.com/faridrashidi/kaggle-solutions [2] https://farid.one/kaggle-solutions/ submitted by /u/faridrashidi [link] [comments]  ( 102 min )

After playing around with the Stable Diffusion source code a bit, I got the idea to use it for lossy image compression and it works even better than expected. Details and colab source code here: https://matthias-buehlmann.medium.com/stable-diffusion-based-image-compresssion-6f1f0a399202?source=friends_link&sk=a7fb68522b16d9c48143626c84172366 submitted by /u/matthias_buehlmann [link] [comments]  ( 101 min )

Thanks submitted by /u/AlternativeDish5596 [link] [comments]  ( 88 min )

I'm curating a list of resources on Online Learning, Multi-Armed Bandits, RL Theory and Online Algorithms at: https://sudeepraja.github.io/ResourceOnlineLearning/ Please send in your recommendations for helpful resources in these topics and related areas. I'll add resources on RL Theory and Online Algorithms soon. submitted by /u/sudeepraja [link] [comments]  ( 105 min )

I'm trying to create an environment for a simple game I played during the pandemic. It was based on a graph whose nodes get infected. We can delete ie 'vaccinate' some nodes before and during the outbreak with an objective of minimising the percentage of infection in our network. What are some interesting questions to ask in this environment? My (one) basic idea was to see if I could use RL to identify and exploit structural properties of graphs (by using a certain type of graph). What more could I explore in this? Are there any RL problems related to graph networks which I can study? submitted by /u/theanswerisnt42 [link] [comments]  ( 87 min )

I've been reading one of the first published papers on IRL by Ng & Abbeel [link], and I'm trying to figure out the shortcoming of the last algorithm proposed in the paper. That algorithm is model-free, does not require given optimal policy (sample trajectories are given instead) and uses linear function approximation for reward functions. So the shortcomings are following: imposing structure on reward function frequent simulation of trajectories (computational burden) reward func is found by optimising a margin which is basically a heuristic As these shortcomings are found also in other IRL papers (although GAIL and other methods alleviate most of these shortcomings nowadays), I was wondering why is this work not found in more practical applications? submitted by /u/Gclass19 [link] [comments]  ( 87 min )

I made a Wordle environment and an algorithm for solving. After some time training, you can see it doing something sensible but I think tuning the rewards, environment or algorithm might make it perform better. Happy to take and merge pull requests if you want to work on it! :) ​ Link: https://github.com/s-sd/wordle-rl Stars appreciated! ;) submitted by /u/ssd123456789 [link] [comments]  ( 88 min )

Hi all! I'm using PPO and I'm encountering a weird phenomenon. At first during training, the entropy loss is decreasing (I interpret this as less exploration, more exploitation, more "certainty" about policy) and my mean reward per episode increases. This is all exactly what I would expect. Then, at a certain point, the entropy loss continues to decrease HOWEVER now the performance starts consistently decreasing as well. I've set up my code to decrease the learning rate when this happens (I've read that adaptively annealing the learning rate can help PPO), but the problem persists. I do not understand why this would happen on a conceptual level, nor on a practical one. Any ideas, insights and advice would be greatly appreciated! I run my model for ~75K training steps before checking its entropy and performance. Here are all the parameters of my model: Learning rate: 0.005, set to decrease by 1/2 every time performance drops during a check Gamma: 0.975 Batch Size: 2048 Rollout Buffer Size: 4 parallel environments x 16,834 n_steps = ~65,500 n_epochs: 2 Network size: Both networks (actor and critic) are 352 x 352 In terms of the actual agent behavior - the agent is getting reasonably good rewards, and then all of a sudden when performance starts dropping, it's because the agent decides to start repeatedly doing a single action. I cannot understand/justify why the agent would change its behavior in such a way when it's already doing pretty well and is on the path to getting even higher rewards. EDIT: Depending on hyperparameters, this sometimes happens immediately. Like, the model starts out after 75K timesteps training at a high score and then never increases again at all, immediately starts dropping. submitted by /u/VladimirB-98 [link] [comments]  ( 91 min )

Hi, I want to create a Custom Neural Network in Pytorch/Tensorflow with learnable parameters in the activation function. The learnable parameters are the weights of layers, but the weights are also to be used inside the activation function in a certain nonlinear relation. Normally, the activation function takes the inputs multiplied with the weights ( e.g, y1=f1(X*W1 + b1)) but here I want to use weights directly inside in a certain nonlinear relation i.e. y1=g1(X*W1 + b1,W1). So, far, the available packages of Pytorch/Tensor flow provide capabilities like adding layers, activation functions, but no library provides such a customization of activation function as per my knowledge. Please, I need some ideas on how to achieve this task? AR submitted by /u/Ahmed-KU [link] [comments]  ( 88 min )

Amazon SageMaker Data Wrangler reduces the time that it takes to aggregate and prepare data for machine learning (ML) from weeks to minutes in Amazon SageMaker Studio, the first fully integrated development environment (IDE) for ML. With Data Wrangler, you can simplify the process of data preparation and feature engineering, and complete each step of […]  ( 7 min )

Pharmaceutical companies seeking approval from regulatory agencies such as the US Food & Drug Administration (FDA) or Japanese Pharmaceuticals and Medical Devices Agency (PMDA) to sell their drugs on the market must submit evidence to prove that their drug is safe and effective for its intended use. A team of physicians, statisticians, chemists, pharmacologists, and […]  ( 10 min )

Amazon SageMaker provides a suite of built-in algorithms, pre-trained models, and pre-built solution templates to help data scientists and machine learning (ML) practitioners get started on training and deploying ML models quickly. These algorithms and models can be used for both supervised and unsupervised learning. They can process various types of input data, including tabular, […]  ( 8 min )

Posted by Weicheng Kuo and Anelia Angelova, Research Scientists, Google Research, Brain Team Natural language enables flexible descriptive queries about images. The interaction between text queries and images grounds linguistic meaning in the visual world, facilitating a better understanding of object relationships, human intentions towards objects, and interactions with the environment. The research community has studied object-level visual grounding through a range of tasks, including referring expression comprehension, text-based localization, and more broadly object detection, each of which require different skills in a model. For example, object detection seeks to find all objects from a predefined set of classes, which requires accurate localization and classification, while referr…  ( 24 min )

A couple days ago I wrote about Costas arrays. In a nutshell, a Costas array of size n is a solution to the n rooks problem, with the added constraint that if you added wires between the rooks, no two wires would have the same length and slope. See the earlier post for more details. […] Costas arrays in Mathematica first appeared on John D. Cook.  ( 5 min )

South Korea’s most popular AI voice assistant, GiGA Genie, converses with 8 million people each day. The AI-powered speaker from telecom company KT can control TVs, offer real-time traffic updates and complete a slew of other home-assistance tasks based on voice commands. It has mastered its conversational skills in the highly complex Korean language thanks Read article > The post No Hang Ups With Hangul: KT Trains Smart Speakers, Customer Call Centers With NVIDIA AI appeared first on NVIDIA Blog.  ( 5 min )

At GTC today, NVIDIA unveiled a number of updates to its DGX portfolio to power new breakthroughs in enterprise AI development. NVIDIA DGX H100 systems are now available for order. These infrastructure building blocks support NVIDIA’s full-stack enterprise AI solutions. With 32 petaflops of performance at FP8 precision, NVIDIA DGX H100 delivers a leap in Read article > The post New NVIDIA DGX System Software and Infrastructure Solutions Supercharge Enterprise AI appeared first on NVIDIA Blog.  ( 6 min )

New cloud services to support AI workflows and the launch of a new generation of GeForce RTX GPUs featured today in NVIDIA CEO Jensen Huang’s GTC keynote, which was packed with new systems, silicon, and software. “Computing is advancing at incredible speeds, the engine propelling this rocket is accelerated computing, and its fuel is AI,” Read article > The post Keynote Wrap-Up: NVIDIA CEO Unveils Next-Gen RTX GPUs, AI Workflows in the Cloud appeared first on NVIDIA Blog.  ( 10 min )

Meet Violet, an AI-powered customer service assistant ready to take your order. Unveiled this week at GTC, Violet is a cloud-based avatar that represents the latest evolution in avatar development through NVIDIA Omniverse Avatar Cloud Engine (ACE), a suite of cloud-native AI microservices that make it easier to build and deploy intelligent virtual assistants and Read article > The post NVIDIA Omniverse ACE Enables Easier, Faster Deployment of Interactive Avatars appeared first on NVIDIA Blog.  ( 6 min )

The latest release of NVIDIA Maxine is paving the way for real-time audio and video communications. Whether for a video conference, a call made to a customer service center, or a live stream, Maxine enables clear communications to enhance virtual interactions. NVIDIA Maxine is a suite of GPU-accelerated AI software development kits (SDKs) and cloud-native Read article > The post New NVIDIA Maxine Cloud-Native Architecture Delivers Breakthrough Audio and Video Quality at Scale appeared first on NVIDIA Blog.  ( 6 min )

Recommender systems, the economic engines of the internet, are getting a new turbocharger: the NVIDIA Grace Hopper Superchip. Every day, recommenders serve up trillions of search results, ads, products, music and news stories to billions of people. They’re among the most important AI models of our time because they’re incredibly effective at finding in the Read article > The post Why the New NVIDIA Grace Hopper Superchip Is Ideal for Next-Gen Recommender Systems appeared first on NVIDIA Blog.  ( 6 min )

As scientists probe for new insights about DNA, proteins and other building blocks of life, the NVIDIA BioNeMo framework — announced today at NVIDIA GTC — will accelerate their research. NVIDIA BioNeMo is a framework for training and deploying large biomolecular language models at supercomputing scale — helping scientists better understand disease and find therapies Read article > The post NVIDIA Expands Large Language Models to Biology appeared first on NVIDIA Blog.  ( 7 min )

Promising to help process images faster and more efficiently at a vast scale, NVIDIA introduced CV-CUDA, an open-source library for building accelerated end-to-end computer vision and image processing pipelines. The majority of internet traffic is video. Increasingly, this video will be augmented by AI special effects and computer graphics. To add to this complexity, fast-growing Read article > The post NVIDIA Introduces Open-Source Project to Accelerate Computer Vision Cloud Applications appeared first on NVIDIA Blog.  ( 5 min )

In her 18 years as a competitive figure skater, Bettina Heim learned to land a lutz with speed and grace. Now, armed with a Ph.D. in quantum computing, she’s helping Microsoft Azure Quantum carve out a position at the cutting edge of cloud services. “I’ve always been attracted to interesting problems and working hard to Read article > The post Growing Range of Researchers, Scientists Adopt NVIDIA cuQuantum and QODA  appeared first on NVIDIA Blog.  ( 6 min )

Robotics developers can span global teams testing for navigation of environments, underscoring the importance of easy access to simulation software for quick input and iterations. At GTC today, NVIDIA founder and CEO Jensen Huang announced that the Isaac Sim robotics simulation platform is now available on the cloud. Developers will have three options to access Read article > The post NVIDIA Robotics Software Jumps to the Cloud, Enabling Collaborative, Accelerated Development of Robots appeared first on NVIDIA Blog.  ( 5 min )

Content creation is booming at an unprecedented rate. Whether it’s a 3D artist sculpting a beautiful piece of art or an aspiring influencer editing their next hit TikTok, more than 110 million professional and hobbyist artists worldwide are creating content on laptops and desktops. The post Creativity Redefined: New GeForce RTX 40 Series GPUs and NVIDIA Studio Updates Accelerate AI Revolution appeared first on NVIDIA Blog.  ( 11 min )

NVIDIA today introduced the NVIDIA IGX platform for medical edge AI use cases, bringing advanced security and safety to intelligent machines and human-machine collaboration. IGX is a hardware and software platform that delivers secure, low-latency AI inference to meet the clinical demand for instant insights from a range of devices and sensors for medical applications, Read article > The post NVIDIA Medical Edge AI Computing Platform Selected by Top Robotic and Digital Surgery Startups appeared first on NVIDIA Blog.  ( 6 min )

NVIDIA today introduced the IGX edge AI computing platform for secure, safe autonomous systems. IGX brings together hardware with programmable safety extensions, commercial operating-system support and powerful AI software — enabling organizations to safely and securely deliver AI in support of human-machine collaboration. The all-in-one platform enables next-level safety, security and perception for use cases Read article > The post New NVIDIA IGX Platform Helps Create Safe, Autonomous Factories of the Future appeared first on NVIDIA Blog.  ( 6 min )

Next-day packages. New vehicle deliveries. Fresh organic produce. Each of these modern conveniences is accelerated by fleets of mobile robots. NVIDIA today is announcing updates to Nova Orin — an autonomous mobile robot (AMR) reference platform — that advance its roadmap. We’re releasing details of three reference platform configurations. Two use a single Jetson AGX Read article > The post NVIDIA Isaac Nova Orin Opens New Era of Innovation for Autonomous Mobile Robots appeared first on NVIDIA Blog.  ( 6 min )

Deutsche Bahn’s rail network consists of 5,700 stations and 33,000 kilometers of track, making it the largest in Western Europe. Digitale Schiene Deutschland (Digital Rail for Germany, or DSD), part of Germany’s national railway operator Deutsche Bahn, is working to increase the network’s capacity without building new tracks. It’s striving to create a powerful railway Read article > The post On Track: Digitale Schiene Deutschland Building Digital Twin of Rail Network in NVIDIA Omniverse appeared first on NVIDIA Blog.  ( 5 min )

With tens of millions of weekly transactions across its more than 2,000 stores, Lowe’s helps customers achieve their home-improvement goals. Now, the Fortune 50 retailer is experimenting with high-tech methods to elevate both the associate and customer experience. Using NVIDIA Omniverse Enterprise to visualize and interact with a store’s digital data, Lowe’s is testing digital Read article > The post Reinventing Retail: Lowe’s Teams With NVIDIA and Magic Leap to Create Interactive Store Digital Twins appeared first on NVIDIA Blog.  ( 6 min )

With NVIDIA DRIVE, in-vehicle infotainment, or IVI, is so much more than just giving directions and playing music. NVIDIA founder and CEO Jensen Huang demonstrated the capabilities of a truly IVI experience during today’s GTC keynote. Using centralized, high-performance compute, the NVIDIA DRIVE Concierge platform spans traditional cockpit and cluster capabilities, as well as personalized, Read article > The post Experience the Future of Vehicle Infotainment: NVIDIA DRIVE Concierge Brings Customized AI to Every Seat appeared first on NVIDIA Blog.  ( 5 min )

The next generation of autonomous vehicle computing is improving performance and efficiency at the speed of light. During today’s GTC keynote, NVIDIA founder and CEO Jensen Huang unveiled DRIVE Thor, a superchip of epic proportions. The automotive-grade system-on-a-chip (SoC) is built on the latest CPU and GPU advances to deliver 2,000 teraflops of performance while Read article > The post NVIDIA DRIVE Thor Strikes AI Performance Balance, Uniting AV and Cockpit on a Single Computer appeared first on NVIDIA Blog.  ( 5 min )

One of the biggest challenges that businesses face with their datasets is duplication. Teams encounter thousands of rows in the customer dataset, knowing that their customers are only in hundreds. Moreover, they find multiple columns that refer to the same information but contain varying data values.   Such incidences are making it impossible for businesses to… Read More »The art of removing duplicates from your organizational data The post The art of removing duplicates from your organizational data appeared first on Data Science Central.  ( 21 min )

A data platform is an integrated set of technologies that collectively meet an organization’s end-to-end data needs. It enables the acquisition, storage, preparation, delivery, and governance of your data, as well as a security layer for users and applications. The post Platform Technical Management – Data Engineering View appeared first on Data Science Central.  ( 19 min )

The world is becoming increasingly complex - as highlighted in my first article here - but the concern isn’t only about being complex. Considering the ever-increasing speed of the state of complexity, we have entered the age of polycrisis. The post Living in a Risk Society – Change, Perpetual Crisis, Comprehension, and Policy appeared first on Data Science Central.  ( 21 min )

Business agility is nearly universally acknowledged to be a prime goal for companies looking to make themselves sustainable in the VUCA world in which we currently operate.  Achieving it requires a journey of transformation and continual evolution.  The post Agility and the Third Derivative appeared first on Data Science Central.  ( 22 min )

The problem of data violation is one of the most threatening issues of being on the internet. The ambiguity regarding the collection, usage, and sharing of our personal and sensitive information adds to the insecurity experienced by most consumers. The post How CPRA Will Change the Face of US Businesses appeared first on Data Science Central.  ( 21 min )

submitted by /u/kenickh [link] [comments]  ( 87 min )

I got intrested in neural networks and deep learning recently and I was wondering if you had courses/videos to recommend for beginners. I know it's an extremely complex topic but I'd still like to try. I've some past prigramming exoerience in c, c++, python, html edit: I'm particularly intrested in evolution simulations. i.e. cars that learn how to drive, AI that learns how to play snake, genetic and environvment evolution simulations submitted by /u/Raimo00 [link] [comments]  ( 87 min )

Hi, all, I know only a little about various architecture of AIs and Neural networks, but I just had a thought: Is it possible to create an AI built of a few neural networks, where there's (a) main one(s) for whatever the task is, but another neural network as a subsystem for modifying the architecture of the main network itself? So imagine you're trying to make train a network to recognize shapes in doodles, however you start noticing that it's limited in the amount of features it takes into consideration, so it misses some key features that are required to identify specific types of doodles. So you could increase the amount of neurons in some layers and/or the amount of layers. However, what if another neural network looked at the prediction rate of the previous network and was able to modify it instead of you? Is it possible to do such a thing? How would such an architecture look like? Please be technical in terminology with me, I'm sure I don't know lots of things and using the right terms will help me be aware of them and that way go learn about them so I can improve my understanding of these ideas and you're saying. submitted by /u/GalGreenfield [link] [comments]  ( 88 min )

Large quantifies of online user activity data, such as weekly web search volumes, which co-evolve with the mutual influence of several queries and locations, serve as an important social sensor. It is an important task to accurately forecast the future activity by discovering latent interactions from such data, i.e., the ecosystems between each query and the flow of influences between each area. However, this is a difficult problem in terms of data quantity and complex patterns covering the dynamics. To tackle the problem, we propose FluxCube, which is an effective mining method that forecasts large collections of co-evolving online user activity and provides good interpretability. Our model is the expansion of a combination of two mathematical models: a reaction-diffusion system provides a framework for modeling the flow of influences between local area groups and an ecological system models the latent interactions between each query. Also, by leveraging the concept of physics-informed neural networks, FluxCube achieves high interpretability obtained from the parameters and high forecasting performance, together. Extensive experiments on real datasets showed that FluxCube outperforms comparable models in terms of the forecasting accuracy, and each component in FluxCube contributes to the enhanced performance. We then show some case studies that FluxCube can extract useful latent interactions between queries and area groups.  ( 3 min )

This work presents solutions to the Traveling Salesperson Problem with precedence constraints (TSPPC) using Deep Reinforcement Learning (DRL) by adapting recent approaches that work well for regular TSPs. Common to these approaches is the use of graph models based on multi-head attention (MHA) layers. One idea for solving the pickup and delivery problem (PDP) is using heterogeneous attentions to embed the different possible roles each node can take. In this work, we generalize this concept of heterogeneous attentions to the TSPPC. Furthermore, we adapt recent ideas to sparsify attentions for better scalability. Overall, we contribute to the research community through the application and evaluation of recent DRL methods in solving the TSPPC.  ( 2 min )

As learning difficulty is crucial for machine learning (e.g., difficulty-based weighting learning strategies), previous literature has proposed a number of learning difficulty measures. However, no comprehensive investigation for learning difficulty is available to date, resulting in that nearly all existing measures are heuristically defined without a rigorous theoretical foundation. In addition, there is no formal definition of easy and hard samples even though they are crucial in many studies. This study attempts to conduct a pilot theoretical study for learning difficulty of samples. First, a theoretical definition of learning difficulty is proposed on the basis of the bias-variance trade-off theory on generalization error. Theoretical definitions of easy and hard samples are established on the basis of the proposed definition. A practical measure of learning difficulty is given as well inspired by the formal definition. Second, the properties for learning difficulty-based weighting strategies are explored. Subsequently, several classical weighting methods in machine learning can be well explained on account of explored properties. Third, the proposed measure is evaluated to verify its reasonability and superiority in terms of several main difficulty factors. The comparison in these experiments indicates that the proposed measure significantly outperforms the other measures throughout the experiments.  ( 3 min )

Many real-world data can be modeled as 3D graphs, but learning representations that incorporates 3D information completely and efficiently is challenging. Existing methods either use partial 3D information, or suffer from excessive computational cost. To incorporate 3D information completely and efficiently, we propose a novel message passing scheme that operates within 1-hop neighborhood. Our method guarantees full completeness of 3D information on 3D graphs by achieving global and local completeness. Notably, we propose the important rotation angles to fulfill global completeness. Additionally, we show that our method is orders of magnitude faster than prior methods. We provide rigorous proof of completeness and analysis of time complexity for our methods. As molecules are in essence quantum systems, we build the \underline{com}plete and \underline{e}fficient graph neural network (ComENet) by combing quantum inspired basis functions and the proposed message passing scheme. Experimental results demonstrate the capability and efficiency of ComENet, especially on real-world datasets that are large in both numbers and sizes of graphs. Our code is publicly available as part of the DIG library (\url{https://github.com/divelab/DIG}).  ( 2 min )

Recurrent State-space models (RSSMs) are highly expressive models for learning patterns in time series data and system identification. However, these models assume that the dynamics are fixed and unchanging, which is rarely the case in real-world scenarios. Many control applications often exhibit tasks with similar but not identical dynamics which can be modeled as a latent variable. We introduce the Hidden Parameter Recurrent State Space Models (HiP-RSSMs), a framework that parametrizes a family of related dynamical systems with a low-dimensional set of latent factors. We present a simple and effective way of learning and performing inference over this Gaussian graphical model that avoids approximations like variational inference. We show that HiP-RSSMs outperforms RSSMs and competing multi-task models on several challenging robotic benchmarks both on real-world systems and simulations.  ( 2 min )

Fluid-flow devices with low dissipation, but high contact area, are of importance in many applications. A well-known strategy to design such devices is multi-scale topology optimization (MTO), where optimal microstructures are designed within each cell of a discretized domain. Unfortunately, MTO is computationally very expensive since one must perform homogenization of the evolving microstructures, during each step of the homogenization process. As an alternate, we propose here a graded multiscale topology optimization (GMTO) for designing fluid-flow devices. In the proposed method, several pre-selected but size-parameterized and orientable microstructures are used to fill the domain optimally. GMTO significantly reduces the computation while retaining many of the benefits of MTO. In particular, GMTO is implemented here using a neural-network (NN) since: (1) homogenization can be performed off-line, and used by the NN during optimization, (2) it enables continuous switching between microstructures during optimization, (3) the number of design variables and computational effort is independent of number of microstructure used, and, (4) it supports automatic differentiation, thereby eliminating manual sensitivity analysis. Several numerical results are presented to illustrate the proposed framework.

Remotely sensed geospatial data are critical for applications including precision agriculture, urban planning, disaster monitoring and response, and climate change research, among others. Deep learning methods are particularly promising for modeling many remote sensing tasks given the success of deep neural networks in similar computer vision tasks and the sheer volume of remotely sensed imagery available. However, the variance in data collection methods and handling of geospatial metadata make the application of deep learning methodology to remotely sensed data nontrivial. For example, satellite imagery often includes additional spectral bands beyond red, green, and blue and must be joined to other geospatial data sources that can have differing coordinate systems, bounds, and resolutions. To help realize the potential of deep learning for remote sensing applications, we introduce TorchGeo, a Python library for integrating geospatial data into the PyTorch deep learning ecosystem. TorchGeo provides data loaders for a variety of benchmark datasets, composable datasets for generic geospatial data sources, samplers for geospatial data, and transforms that work with multispectral imagery. TorchGeo is also the first library to provide pre-trained models for multispectral satellite imagery (e.g., models that use all bands from the Sentinel-2 satellites), allowing for advances in transfer learning on downstream remote sensing tasks with limited labeled data. We use TorchGeo to create reproducible benchmark results on existing datasets and benchmark our proposed method for preprocessing geospatial imagery on the fly. TorchGeo is open source and available on GitHub: https://github.com/microsoft/torchgeo.

In this paper, we study the problem of PAC learning halfspaces in the non-interactive local differential privacy model (NLDP). To breach the barrier of exponential sample complexity, previous results studied a relaxed setting where the server has access to some additional public but unlabeled data. We continue in this direction. Specifically, we consider the problem under the standard setting instead of the large margin setting studied before. Under different mild assumptions on the underlying data distribution, we propose two approaches that are based on the Massart noise model and self-supervised learning and show that it is possible to achieve sample complexities that are only linear in the dimension and polynomial in other terms for both private and public data, which significantly improve the previous results. Our methods could also be used for other private PAC learning problems.

The past decade has witnessed transformative applications of deep learning in various computational imaging, sensing and microscopy tasks. Due to the supervised learning schemes employed, most of these methods depend on large-scale, diverse, and labeled training data. The acquisition and preparation of such training image datasets are often laborious and costly, also leading to biased estimation and limited generalization to new types of samples. Here, we report a self-supervised learning model, termed GedankenNet, that eliminates the need for labeled or experimental training data, and demonstrate its effectiveness and superior generalization on hologram reconstruction tasks. Without prior knowledge about the sample types to be imaged, the self-supervised learning model was trained using a physics-consistency loss and artificial random images that are synthetically generated without any experiments or resemblance to real-world samples. After its self-supervised training, GedankenNet successfully generalized to experimental holograms of various unseen biological samples, reconstructing the phase and amplitude images of different types of objects using experimentally acquired test holograms. Without access to experimental data or the knowledge of real samples of interest or their spatial features, GedankenNet's self-supervised learning achieved complex-valued image reconstructions that are consistent with the Maxwell's equations, meaning that its output inference and object solutions accurately represent the wave propagation in free-space. This self-supervised learning of image reconstruction tasks opens up new opportunities for various inverse problems in holography, microscopy and computational imaging fields.

Graph-level representation learning is the pivotal step for downstream tasks that operate on the whole graph. The most common approach to this problem heretofore is graph pooling, where node features are typically averaged or summed to obtain the graph representations. However, pooling operations like averaging or summing inevitably cause massive information missing, which may severely downgrade the final performance. In this paper, we argue what is crucial to graph-level downstream tasks includes not only the topological structure but also the distribution from which nodes are sampled. Therefore, powered by existing Graph Neural Networks (GNN), we propose a new plug-and-play pooling module, termed as Distribution Knowledge Embedding (DKEPool), where graphs are rephrased as distributions on top of GNNs and the pooling goal is to summarize the entire distribution information instead of retaining a certain feature vector by simple predefined pooling operations. A DKEPool network de facto disassembles representation learning into two stages, structure learning and distribution learning. Structure learning follows a recursive neighborhood aggregation scheme to update node features where structure information is obtained. Distribution learning, on the other hand, omits node interconnections and focuses more on the distribution depicted by all the nodes. Extensive experiments demonstrate that the proposed DKEPool significantly and consistently outperforms the state-of-the-art methods.

Photoactive iridium complexes are of broad interest due to their applications ranging from lighting to photocatalysis. However, the excited state property prediction of these complexes challenges ab initio methods such as time-dependent density functional theory (TDDFT) both from an accuracy and a computational cost perspective, complicating high throughput virtual screening (HTVS). We instead leverage low-cost machine learning (ML) models to predict the excited state properties of photoactive iridium complexes. We use experimental data of 1,380 iridium complexes to train and evaluate the ML models and identify the best-performing and most transferable models to be those trained on electronic structure features from low-cost density functional theory tight binding calculations. Using these models, we predict the three excited state properties considered, mean emission energy of phosphorescence, excited state lifetime, and emission spectral integral, with accuracy competitive with or superseding TDDFT. We conduct feature importance analysis to identify which iridium complex attributes govern excited state properties and we validate these trends with explicit examples. As a demonstration of how our ML models can be used for HTVS and the acceleration of chemical discovery, we curate a set of novel hypothetical iridium complexes and identify promising ligands for the design of new phosphors.

This paper proposes a novel scoring function for the planning module of MPC-based model-based reinforcement learning methods to address the inherent bias of using the reward function to score trajectories. The proposed method enhances the learning efficiency of existing MPC-based MBRL methods using the discounted sum of values. The method utilizes optimal trajectories to guide policy learning and updates its state-action value function based on real-world and augmented on-board data. The learning efficiency of the proposed method is evaluated in selected MuJoCo Gym environments as well as in learning locomotion skills for a simulated model of the Cassie robot. The results demonstrate that the proposed method outperforms the current state-of-the-art algorithms in terms of learning efficiency and average reward return.

Over a five-year period, computing methods for generating high-fidelity, fictional depictions of people and events moved from exotic demonstrations by computer science research teams into ongoing use as a tool of disinformation. The methods, referred to with the portmanteau of "deepfakes," have been used to create compelling audiovisual content. Here, I share challenges ahead with malevolent uses of two classes of deepfakes that we can expect to come into practice with costly implications for society: interactive and compositional deepfakes. Interactive deepfakes have the capability to impersonate people with realistic interactive behaviors, taking advantage of advances in multimodal interaction. Compositional deepfakes leverage synthetic content in larger disinformation plans that integrate sets of deepfakes over time with observed, expected, and engineered world events to create persuasive synthetic histories. Synthetic histories can be constructed manually but may one day be guided by adversarial generative explanation (AGE) techniques. In the absence of mitigations, interactive and compositional deepfakes threaten to move us closer to a post-epistemic world, where fact cannot be distinguished from fiction. I shall describe interactive and compositional deepfakes and reflect about cautions and potential mitigations to defend against them.

Most Graph Neural Networks (GNNs) cannot distinguish some graphs or indeed some pairs of nodes within a graph. This makes it impossible to solve certain classification tasks. However, adding additional node features to these models can resolve this problem. We introduce several such augmentations, including (i) positional node embeddings, (ii) canonical node IDs, and (iii) random features. These extensions are motivated by theoretical results and corroborated by extensive testing on synthetic subgraph detection tasks. We find that positional embeddings significantly outperform other extensions in these tasks. Moreover, positional embeddings have better sample efficiency, perform well on different graph distributions and even outperform learning with ground truth node positions. Finally, we show that the different augmentations perform competitively on established GNN benchmarks, and advise on when to use them.

Though deep reinforcement learning (DRL) has obtained substantial success, it may encounter catastrophic failures due to the intrinsic uncertainty of both transition and observation. Most of the existing methods for safe reinforcement learning can only handle transition disturbance or observation disturbance since these two kinds of disturbance affect different parts of the agent; besides, the popular worst-case return may lead to overly pessimistic policies. To address these issues, we first theoretically prove that the performance degradation under transition disturbance and observation disturbance depends on a novel metric of Value Function Range (VFR), which corresponds to the gap in the value function between the best state and the worst state. Based on the analysis, we adopt conditional value-at-risk (CVaR) as an assessment of risk and propose a novel reinforcement learning algorithm of CVaR-Proximal-Policy-Optimization (CPPO) which formalizes the risk-sensitive constrained optimization problem by keeping its CVaR under a given threshold. Experimental results show that CPPO achieves a higher cumulative reward and is more robust against both observation and transition disturbances on a series of continuous control tasks in MuJoCo.

This paper addresses two major challenges in terahertz (THz) channel estimation: the beam-split phenomenon, i.e., beam misalignment because of frequency-independent analog beamformers, and computational complexity because of the usage of ultra-massive number of antennas to compensate propagation losses. Data-driven techniques are known to mitigate the complexity of this problem but usually require the transmission of the datasets from the users to a central server entailing huge communication overhead. In this work, we employ federated learning (FL), wherein the users transmit only the model parameters instead of the whole dataset, for THz channel estimation to improve the communications-efficiency. In order to accurately estimate the channel despite beam-split, we propose a beamspace support alignment (BSA) technique. By exploiting the sparsity of the THz channel, the proposed approach is implemented with fewer pilot signals than the traditional techniques. Compared to the previous works, our FL-BSA approach provides higher channel estimation accuracy as well as approximately 68 (32) times lower model (channel) training overhead, respectively.

Upper limb movement classification, which maps input signals to the target activities, is a key building block in the control of rehabilitative robotics. Classifiers are trained for the rehabilitative system to comprehend the desires of the patient whose upper limbs do not function properly. Electromyography (EMG) signals and Electroencephalography (EEG) signals are used widely for upper limb movement classification. By analysing the classification results of the real-time EEG and EMG signals, the system can understand the intention of the user and predict the events that one would like to carry out. Accordingly, it will provide external help to the user. However, the noise in the real-time EEG and EMG data collection process contaminates the effectiveness of the data, which undermines classification performance. Moreover, not all patients process strong EMG signals due to muscle damage and neuromuscular disorder. To address these issues, this paper explores different feature extraction techniques and machine learning and deep learning models for EEG and EMG signals classification and proposes a novel decision-level multisensor fusion technique to integrate EEG signals with EMG signals. This system retrieves effective information from both sources to understand and predict the desire of the user, and thus aid. By testing out the proposed technique on a publicly available WAY-EEG-GAL dataset, which contains EEG and EMG signals that were recorded simultaneously, we manage to conclude the feasibility and effectiveness of the novel system.

Over-parameterized models, typically pretrained language models (LMs), have shown an appealing expressive power due to their small learning bias. However, the huge learning capacity of LMs can also lead to large learning variance. In a pilot study, we find that, when faced with multiple domains, a critical portion of parameters behave unexpectedly in a domain-specific manner while others behave in a domain-general one. Motivated by this phenomenon, we for the first time posit that domain-general parameters can underpin a domain-general LM that can be derived from the original LM. To uncover the domain-general LM, we propose to identify domain-general parameters by playing lottery tickets (dubbed doge tickets). In order to intervene the lottery, we propose a domain-general score, which depicts how domain-invariant a parameter is by associating it with the variance. Comprehensive experiments are conducted on the Amazon, Mnli and OntoNotes datasets. The results show that the doge tickets obtains an improved out-of-domain generalization in comparison with a range of competitive baselines. Analysis results further hint the existence of domain-general parameters and the performance consistency of doge tickets.

Subgraph GNNs are a recent class of expressive Graph Neural Networks (GNNs) which model graphs as collections of subgraphs. So far, the design space of possible Subgraph GNN architectures as well as their basic theoretical properties are still largely unexplored. In this paper, we study the most prominent form of subgraph methods, which employs node-based subgraph selection policies such as ego-networks or node marking and deletion. We address two central questions: (1) What is the upper-bound of the expressive power of these methods? and (2) What is the family of equivariant message passing layers on these sets of subgraphs?. Our first step in answering these questions is a novel symmetry analysis which shows that modelling the symmetries of node-based subgraph collections requires a significantly smaller symmetry group than the one adopted in previous works. This analysis is then used to establish a link between Subgraph GNNs and Invariant Graph Networks (IGNs). We answer the questions above by first bounding the expressive power of subgraph methods by 3-WL, and then proposing a general family of message-passing layers for subgraph methods that generalises all previous node-based Subgraph GNNs. Finally, we design a novel Subgraph GNN dubbed SUN, which theoretically unifies previous architectures while providing better empirical performance on multiple benchmarks.

Implicit feedback is frequently used for developing personalized recommendation services due to its ubiquity and accessibility in real-world systems. In order to effectively utilize such information, most research adopts the pairwise ranking method on constructed training triplets (user, positive item, negative item) and aims to distinguish between positive items and negative items for each user. However, most of these methods treat all the training triplets equally, which ignores the subtle difference between different positive or negative items. On the other hand, even though some other works make use of the auxiliary information (e.g., dwell time) of user behaviors to capture this subtle difference, such auxiliary information is hard to obtain. To mitigate the aforementioned problems, we propose a novel training framework named Triplet Importance Learning (TIL), which adaptively learns the importance score of training triplets. We devise two strategies for the importance score generation and formulate the whole procedure as a bilevel optimization, which does not require any rule-based design. We integrate the proposed training procedure with several Matrix Factorization (MF)- and Graph Neural Network (GNN)-based recommendation models, demonstrating the compatibility of our framework. Via a comparison using three real-world datasets with many state-of-the-art methods, we show that our proposed method outperforms the best existing models by 3-21\% in terms of Recall@k for the top-k recommendation.

Natural language is one of the most intuitive ways to express human intent. However, translating instructions and commands towards robotic motion generation and deployment in the real world is far from being an easy task. The challenge of combining a robot's inherent low-level geometric and kinodynamic constraints with a human's high-level semantic instructions traditionally is solved using task-specific solutions with little generalizability between hardware platforms, often with the use of static sets of target actions and commands. This work instead proposes a flexible language-based framework that allows a user to modify generic robotic trajectories. Our method leverages pre-trained language models (BERT and CLIP) to encode the user's intent and target objects directly from a free-form text input and scene images, fuses geometrical features generated by a transformer encoder network, and finally outputs trajectories using a transformer decoder, without the need of priors related to the task or robot information. We significantly extend our own previous work presented in Bucker et al. by expanding the trajectory parametrization space to 3D and velocity as opposed to just XY movements. In addition, we now train the model to use actual images of the objects in the scene for context (as opposed to textual descriptions), and we evaluate the system in a diverse set of scenarios beyond manipulation, such as aerial and legged robots. Our simulated and real-life experiments demonstrate that our transformer model can successfully follow human intent, modifying the shape and speed of trajectories within multiple environments. Codebase available at: https://github.com/arthurfenderbucker/LaTTe-Language-Trajectory-TransformEr.git

Most real-world problems that machine learning algorithms are expected to solve face the situation with 1) unknown data distribution; 2) little domain-specific knowledge; and 3) datasets with limited annotation. We propose Non-Parametric learning by Compression with Latent Variables (NPC-LV), a learning framework for any dataset with abundant unlabeled data but very few labeled ones. By only training a generative model in an unsupervised way, the framework utilizes the data distribution to build a compressor. Using a compressor-based distance metric derived from Kolmogorov complexity, together with few labeled data, NPC-LV classifies without further training. We show that NPC-LV outperforms supervised methods on all three datasets on image classification in low data regime and even outperform semi-supervised learning methods on CIFAR-10. We demonstrate how and when negative evidence lowerbound (nELBO) can be used as an approximate compressed length for classification. By revealing the correlation between compression rate and classification accuracy, we illustrate that under NPC-LV, the improvement of generative models can enhance downstream classification accuracy.

We introduce the Block-Recurrent Transformer, which applies a transformer layer in a recurrent fashion along a sequence, and has linear complexity with respect to sequence length. Our recurrent cell operates on blocks of tokens rather than single tokens during training, and leverages parallel computation within a block in order to make efficient use of accelerator hardware. The cell itself is strikingly simple. It is merely a transformer layer: it uses self-attention and cross-attention to efficiently compute a recurrent function over a large set of state vectors and tokens. Our design was inspired in part by LSTM cells, and it uses LSTM-style gates, but it scales the typical LSTM cell up by several orders of magnitude. Our implementation of recurrence has the same cost in both computation time and parameter count as a conventional transformer layer, but offers dramatically improved perplexity in language modeling tasks over very long sequences. Our model out-performs a long-range Transformer XL baseline by a wide margin, while running twice as fast. We demonstrate its effectiveness on PG19 (books), arXiv papers, and GitHub source code. Our code has been released as open source.

We study the problem of safe and intention-aware robot navigation in dense and interactive crowds. Most previous reinforcement learning (RL) based methods fail to consider different types of interactions among all agents or ignore the intentions of people, which results in performance degradation. In this paper, we propose a novel recurrent graph neural network with attention mechanisms to capture heterogeneous interactions among agents through space and time. To encourage longsighted robot behaviors, we infer the intentions of dynamic agents by predicting their future trajectories for several timesteps. The predictions are incorporated into a model-free RL framework to prevent the robot from intruding into the intended paths of other agents. We demonstrate that our method enables the robot to achieve good navigation performance and non-invasiveness in challenging crowd navigation scenarios. We successfully transfer the policy learned in simulation to a real-world TurtleBot 2i.

We are now witnessing significant progress of deep learning methods in a variety of tasks (or datasets) of proteins. However, there is a lack of a standard benchmark to evaluate the performance of different methods, which hinders the progress of deep learning in this field. In this paper, we propose such a benchmark called PEER, a comprehensive and multi-task benchmark for Protein sEquence undERstanding. PEER provides a set of diverse protein understanding tasks including protein function prediction, protein localization prediction, protein structure prediction, protein-protein interaction prediction, and protein-ligand interaction prediction. We evaluate different types of sequence-based methods for each task including traditional feature engineering approaches, different sequence encoding methods as well as large-scale pre-trained protein language models. In addition, we also investigate the performance of these methods under the multi-task learning setting. Experimental results show that large-scale pre-trained protein language models achieve the best performance for most individual tasks, and jointly training multiple tasks further boosts the performance. The datasets and source codes of this benchmark are all available at https://github.com/DeepGraphLearning/PEER_Benchmark

Numbers are essential components of text, like any other word tokens, from which natural language processing (NLP) models are built and deployed. Though numbers are typically not accounted for distinctly in most NLP tasks, there is still an underlying amount of numeracy already exhibited by NLP models. In this work, we attempt to tap this potential of state-of-the-art NLP models and transfer their ability to boost performance in related tasks. Our proposed classification of numbers into entities helps NLP models perform well on several tasks, including a handcrafted Fill-In-The-Blank (FITB) task and on question answering using joint embeddings, outperforming the BERT and RoBERTa baseline classification.

High-quality medical systematic reviews require comprehensive literature searches to ensure the recommendations and outcomes are sufficiently reliable. Indeed, searching for relevant medical literature is a key phase in constructing systematic reviews and often involves domain (medical researchers) and search (information specialists) experts in developing the search queries. Queries in this context are highly complex, based on Boolean logic, include free-text terms and index terms from standardised terminologies (e.g., the Medical Subject Headings (MeSH) thesaurus), and are difficult and time-consuming to build. The use of MeSH terms, in particular, has been shown to improve the quality of the search results. However, identifying the correct MeSH terms to include in a query is difficult: information experts are often unfamiliar with the MeSH database and unsure about the appropriateness of MeSH terms for a query. Naturally, the full value of the MeSH terminology is often not fully exploited. This article investigates methods to suggest MeSH terms based on an initial Boolean query that includes only free-text terms. In this context, we devise lexical and pre-trained language models based methods. These methods promise to automatically identify highly effective MeSH terms for inclusion in a systematic review query. Our study contributes an empirical evaluation of several MeSH term suggestion methods. We further contribute an extensive analysis of MeSH term suggestions for each method and how these suggestions impact the effectiveness of Boolean queries.

Weather Forecasting is an attractive challengeable task due to its influence on human life and complexity in atmospheric motion. Supported by massive historical observed time series data, the task is suitable for data-driven approaches, especially deep neural networks. Recently, the Graph Neural Networks (GNNs) based methods have achieved excellent performance for spatio-temporal forecasting. However, the canonical GNNs-based methods only individually model the local graph of meteorological variables per station or the global graph of whole stations, lacking information interaction between meteorological variables in different stations. In this paper, we propose a novel Hierarchical Spatio-Temporal Graph Neural Network (HiSTGNN) to model cross-regional spatio-temporal correlations among meteorological variables in multiple stations. An adaptive graph learning layer and spatial graph convolution are employed to construct self-learning graph and study hidden dependency among nodes of variable-level and station-level graph. For capturing temporal pattern, the dilated inception as the backbone of gate temporal convolution is designed to model long and various meteorological trends. Moreover, a dynamic interaction learning is proposed to build bidirectional information passing in hierarchical graph. Experimental results on three real-world meteorological datasets demonstrate the superior performance of HiSTGNN beyond 7 baselines and it reduces the errors by 4.2% to 11.6% especially compared to state-of-the-art weather forecasting method.

Purpose: We perform anatomical landmarking for craniomaxillofacial (CMF) bones without explicitly segmenting them. Towards this, we propose a new simple yet efficient deep network architecture, called \textit{relational reasoning network (RRN)}, to accurately learn the local and the global relations among the landmarks in CMF bones; specifically, mandible, maxilla, and nasal bones. Approach: The proposed RRN works in an end-to-end manner, utilizing learned relations of the landmarks based on dense-block units. For a given few landmarks as input, RRN treats the landmarking process similar to a data imputation problem where predicted landmarks are considered missing. Results: We applied RRN to cone beam computed tomography scans obtained from 250 patients. With a 4-fold cross validation technique, we obtained an average root mean squared error of less than 2 mm per landmark. Our proposed RRN has revealed unique relationships among the landmarks that help us in inferring several \textit{reasoning} about informativeness of the landmark points. The proposed system identifies the missing landmark locations accurately even when severe pathology or deformation are present in the bones. Conclusions: Accurately identifying anatomical landmarks is a crucial step in deformation analysis and surgical planning for CMF surgeries. Achieving this goal without the need for explicit bone segmentation addresses a major limitation of segmentation based approaches, where segmentation failure (as often the case in bones with severe pathology or deformation) could easily lead to incorrect landmarking. To the best of our knowledge, this is the first of its kind algorithm finding anatomical relations of the objects using deep learning.

With the advancement of deep learning techniques, an increasing number of methods have been proposed for optic disc and cup (OD/OC) segmentation from the fundus images. Clinically, OD/OC segmentation is often annotated by multiple clinical experts to mitigate the personal bias. However, it is hard to train the automated deep learning models on multiple labels. A common practice to tackle the issue is majority vote, e.g., taking the average of multiple labels. However such a strategy ignores the different expertness of medical experts. Motivated by the observation that OD/OC segmentation is often used for the glaucoma diagnosis clinically, in this paper, we propose a novel strategy to fuse the multi-rater OD/OC segmentation labels via the glaucoma diagnosis performance. Specifically, we assess the expertness of each rater through an attentive glaucoma diagnosis network. For each rater, its contribution for the diagnosis will be reflected as an expertness map. To ensure the expertness maps are general for different glaucoma diagnosis models, we further propose an Expertness Generator (ExpG) to eliminate the high-frequency components in the optimization process. Based on the obtained expertness maps, the multi-rater labels can be fused as a single ground-truth which we dubbed as Diagnosis First Ground-truth (DiagFirstGT). Experimental results show that by using DiagFirstGT as ground-truth, OD/OC segmentation networks will predict the masks with superior glaucoma diagnosis performance.

Machine unlearning is a process of removing the impact of some training data from the machine learning (ML) models upon receiving removal requests. While straightforward and legitimate, retraining the ML model from scratch incurs a high computational overhead. To address this issue, a number of approximate algorithms have been proposed in the domain of image and text data, among which SISA is the state-of-the-art solution. It randomly partitions the training set into multiple shards and trains a constituent model for each shard. However, directly applying SISA to the graph data can severely damage the graph structural information, and thereby the resulting ML model utility. In this paper, we propose GraphEraser, a novel machine unlearning framework tailored to graph data. Its contributions include two novel graph partition algorithms and a learning-based aggregation method. We conduct extensive experiments on five real-world graph datasets to illustrate the unlearning efficiency and model utility of GraphEraser. It achieves 2.06$\times$ (small dataset) to 35.94$\times$ (large dataset) unlearning time improvement. On the other hand, GraphEraser achieves up to $62.5\%$ higher F1 score and our proposed learning-based aggregation method achieves up to $112\%$ higher F1 score.\footnote{Our code is available at \url{https://github.com/MinChen00/Graph-Unlearning}.}

There are many contexts in which dyadic data are present. Social networks are a well-known example. In these contexts, pairs of elements are linked building a network that reflects interactions. Explaining why these relationships are established is essential to obtain transparency, an increasingly important notion. These explanations are often presented using text, thanks to the spread of the natural language understanding tasks. Our aim is to represent and explain pairs established by any agent (e.g., a recommender system or a paid promotion mechanism), so that text-based personalisation is taken into account. We have focused on the TripAdvisor platform, considering the applicability to other dyadic data contexts. The items are a subset of users and restaurants and the interactions the reviews posted by these users. We propose the PTER (Personalised TExt-based Reviews) model. We predict, from the available reviews for a given restaurant, those that fit to the specific user interactions. PTER leverages the BERT (Bidirectional Encoders Representations from Transformers) transformer-encoder model. We customised a deep neural network following the feature-based approach, presenting a LTR (Learning To Rank) downstream task. We carried out several comparisons of our proposal with a random baseline and other models of the state of the art, following the EXTRA (EXplanaTion RAnking) benchmark. Our method outperforms other collaborative filtering proposals.

The staple of human intelligence is the capability of acquiring knowledge in a continuous fashion. In stark contrast, Deep Networks forget catastrophically and, for this reason, the sub-field of Class-Incremental Continual Learning fosters methods that learn a sequence of tasks incrementally, blending sequentially-gained knowledge into a comprehensive prediction. This work aims at assessing and overcoming the pitfalls of our previous proposal Dark Experience Replay (DER), a simple and effective approach that combines rehearsal and Knowledge Distillation. Inspired by the way our minds constantly rewrite past recollections and set expectations for the future, we endow our model with the abilities to i) revise its replay memory to welcome novel information regarding past data ii) pave the way for learning yet unseen classes. We show that the application of these strategies leads to remarkable improvements; indeed, the resulting method - termed eXtended-DER (X-DER) - outperforms the state of the art on both standard benchmarks (such as CIFAR-100 and miniImagenet) and a novel one here introduced. To gain a better understanding, we further provide extensive ablation studies that corroborate and extend the findings of our previous research (e.g. the value of Knowledge Distillation and flatter minima in continual learning setups).

This paper presents the HiPart package, an open-source native python library that provides efficient and interpret-able implementations of divisive hierarchical clustering algorithms. HiPart supports interactive visualizations for the manipulation of the execution steps allowing the direct intervention of the clustering outcome. This package is highly suited for Big Data applications as the focus has been given to the computational efficiency of the implemented clustering methodologies. The dependencies used are either Python build-in packages or highly maintained stable external packages. The software is provided under the MIT license. The package's source code and documentation can be found at https://github.com/panagiotisanagnostou/HiPart.

Within the mathematical finance literature there is a rich catalogue of mathematical models for studying algorithmic trading problems -- such as market-making and optimal execution -- in limit order books. This paper introduces \mbtgym, a Python module that provides a suite of gym environments for training reinforcement learning (RL) agents to solve such model-based trading problems. The module is set up in an extensible way to allow the combination of different aspects of different models. It supports highly efficient implementations of vectorized environments to allow faster training of RL agents. In this paper, we motivate the challenge of using RL to solve such model-based limit order book problems in mathematical finance, we explain the design of our gym environment, and then demonstrate its use in solving standard and non-standard problems from the literature. Finally, we lay out a roadmap for further development of our module, which we provide as an open source repository on GitHub so that it can serve as a focal point for RL research in model-based algorithmic trading.

Given a long list of anomaly detection algorithms developed in the last few decades, how do they perform with regard to (i) varying levels of supervision, (ii) different types of anomalies, and (iii) noisy and corrupted data? In this work, we answer these key questions by conducting (to our best knowledge) the most comprehensive anomaly detection benchmark with 30 algorithms on 57 benchmark datasets, named ADBench. Our extensive experiments (98,436 in total) identify meaningful insights into the role of supervision and anomaly types, and unlock future directions for researchers in algorithm selection and design. With ADBench, researchers can easily conduct comprehensive and fair evaluations for newly proposed methods on the datasets (including our contributed ones from natural language and computer vision domains) against the existing baselines. To foster accessibility and reproducibility, we fully open-source ADBench and the corresponding results.

We develop a modified online mirror descent framework that is suitable for building adaptive and parameter-free algorithms in unbounded domains. We leverage this technique to develop the first unconstrained online linear optimization algorithm achieving an optimal dynamic regret bound, and we further demonstrate that natural strategies based on Follow-the-Regularized-Leader are unable to achieve similar results. We also apply our mirror descent framework to build new parameter-free implicit updates, as well as a simplified and improved unconstrained scale-free algorithm.

Optical coherence tomography (OCT) imaging from different camera devices causes challenging domain shifts and can cause a severe drop in accuracy for machine learning models. In this work, we introduce a minimal noise adaptation method based on a singular value decomposition (SVDNA) to overcome the domain gap between target domains from three different device manufacturers in retinal OCT imaging. Our method utilizes the difference in noise structure to successfully bridge the domain gap between different OCT devices and transfer the style from unlabeled target domain images to source images for which manual annotations are available. We demonstrate how this method, despite its simplicity, compares or even outperforms state-of-the-art unsupervised domain adaptation methods for semantic segmentation on a public OCT dataset. SVDNA can be integrated with just a few lines of code into the augmentation pipeline of any network which is in contrast to many state-of-the-art domain adaptation methods which often need to change the underlying model architecture or train a separate style transfer model. The full code implementation for SVDNA is available at https://github.com/ValentinKoch/SVDNA.

We introduce a simple and intuitive framework that provides quantitative explanations of statistical models through the probabilistic assessment of input feature importance. The core idea comes from utilizing the Dirichlet distribution to define the importance of input features and learning it via approximate Bayesian inference. The learned importance has probabilistic interpretation and provides the relative significance of each input feature to a model's output, additionally assessing confidence about its importance quantification. As a consequence of using the Dirichlet distribution over the explanations, we can define a closed-form divergence to gauge the similarity between learned importance under different models. We use this divergence to study the feature importance explainability tradeoffs with essential notions in modern machine learning, such as privacy and fairness. Furthermore, BIF can work on two levels: global explanation (feature importance across all data instances) and local explanation (individual feature importance for each data instance). We show the effectiveness of our method on a variety of synthetic and real datasets, taking into account both tabular and image datasets. The code is available at https://github.com/kamadforge/featimp_dp.

Ventricular tachycardia (VT) can be one cause of sudden cardiac death affecting 4.25 million persons per year worldwide. A curative treatment is catheter ablation in order to inactivate the abnormally triggering regions. To facilitate and expedite the localization during the ablation procedure, we present two novel localization techniques based on convolutional neural networks (CNNs). In contrast to existing methods, e.g. using ECG imaging, our approaches were designed to be independent of the patient-specific geometries and directly applicable to surface ECG signals, while also delivering a binary transmural position. One method outputs ranked alternative solutions. Results can be visualized either on a generic or patient geometry. The CNNs were trained on a data set containing only simulated data and evaluated both on simulated and clinical test data. On simulated data, the median test error was below 3mm. The median localization error on the clinical data was as low as 32mm. The transmural position was correctly detected in up to 82% of all clinical cases. Using the ranked alternative solutions, the top-3 median error dropped to 20mm on clinical data. These results demonstrate a proof of principle to utilize CNNs to localize the activation source without the intrinsic need of patient-specific geometrical information. Furthermore, delivering multiple solutions can help the physician to find the real activation source amongst more than one possible locations. With further optimization, these methods have a high potential to speed up clinical interventions. Consequently they could decrease procedural risk and improve VT patients' outcomes.

Networks are ubiquitous in many real-world applications (e.g., social networks encoding trust/distrust relationships, correlation networks arising from time series data). While many networks are signed or directed, or both, there is a lack of unified software packages on graph neural networks (GNNs) specially designed for signed and directed networks. In this paper, we present PyTorch Geometric Signed Directed, a software package which fills this gap. Along the way, we also provide a brief review surveying typical tasks, loss functions and evaluation metrics in the analysis of signed and directed networks, discuss data used in related experiments, provide an overview of methods proposed, and evaluate the implemented methods with experiments. The deep learning framework consists of easy-to-use GNN models, synthetic and real-world data, as well as task-specific evaluation metrics and loss functions for signed and directed networks. As an extension library for PyTorch Geometric, our proposed software is maintained with open-source releases, detailed documentation, continuous integration, unit tests and code coverage checks. Our code is publicly available at \url{https://github.com/SherylHYX/pytorch_geometric_signed_directed}.

We present a new technique for the accelerated training of physics-informed neural networks (PINNs): discretely-trained PINNs (DT-PINNs). The repeated computation of partial derivative terms in the PINN loss functions via automatic differentiation during training is known to be computationally expensive, especially for higher-order derivatives. DT-PINNs are trained by replacing these exact spatial derivatives with high-order accurate numerical discretizations computed using meshless radial basis function-finite differences (RBF-FD) and applied via sparse-matrix vector multiplication. The use of RBF-FD allows for DT-PINNs to be trained even on point cloud samples placed on irregular domain geometries. Additionally, though traditional PINNs (vanilla-PINNs) are typically stored and trained in 32-bit floating-point (fp32) on the GPU, we show that for DT-PINNs, using fp64 on the GPU leads to significantly faster training times than fp32 vanilla-PINNs with comparable accuracy. We demonstrate the efficiency and accuracy of DT-PINNs via a series of experiments. First, we explore the effect of network depth on both numerical and automatic differentiation of a neural network with random weights and show that RBF-FD approximations of third-order accuracy and above are more efficient while being sufficiently accurate. We then compare the DT-PINNs to vanilla-PINNs on both linear and nonlinear Poisson equations and show that DT-PINNs achieve similar losses with 2-4x faster training times on a consumer GPU. Finally, we also demonstrate that similar results can be obtained for the PINN solution to the heat equation (a space-time problem) by discretizing the spatial derivatives using RBF-FD and using automatic differentiation for the temporal derivative. Our results show that fp64 DT-PINNs offer a superior cost-accuracy profile to fp32 vanilla-PINNs.

In this paper, we study the statistical limits in terms of Sobolev norms of gradient descent for solving inverse problem from randomly sampled noisy observations using a general class of objective functions. Our class of objective functions includes Sobolev training for kernel regression, Deep Ritz Methods (DRM), and Physics Informed Neural Networks (PINN) for solving elliptic partial differential equations (PDEs) as special cases. We consider a potentially infinite-dimensional parameterization of our model using a suitable Reproducing Kernel Hilbert Space and a continuous parameterization of problem hardness through the definition of kernel integral operators. We prove that gradient descent over this objective function can also achieve statistical optimality and the optimal number of passes over the data increases with sample size. Based on our theory, we explain an implicit acceleration of using a Sobolev norm as the objective function for training, inferring that the optimal number of epochs of DRM becomes larger than the number of PINN when both the data size and the hardness of tasks increase, although both DRM and PINN can achieve statistical optimality.

Reinforcement learning (RL) techniques have been developed to optimize industrial cooling systems, offering substantial energy savings compared to traditional heuristic policies. A major challenge in industrial control involves learning behaviors that are feasible in the real world due to machinery constraints. For example, certain actions can only be executed every few hours while other actions can be taken more frequently. Without extensive reward engineering and experimentation, an RL agent may not learn realistic operation of machinery. To address this, we use hierarchical reinforcement learning with multiple agents that control subsets of actions according to their operation time scales. Our hierarchical approach achieves energy savings over existing baselines while maintaining constraints such as operating chillers within safe bounds in a simulated HVAC control environment.

Parameter learning for high-dimensional, partially observed, and nonlinear stochastic processes is a methodological challenge. Spatiotemporal disease transmission systems provide examples of such processes giving rise to open inference problems. We propose the iterated block particle filter (IBPF) algorithm for learning high-dimensional parameters over graphical state space models with general state spaces, measures, transition densities and graph structure. Theoretical performance guarantees are obtained on beating the curse of dimensionality (COD), algorithm convergence, and likelihood maximization. Experiments on a highly nonlinear and non-Gaussian spatiotemporal model for measles transmission reveal that the iterated ensemble Kalman filter algorithm (Li et al. (2020)) is ineffective and the iterated filtering algorithm (Ionides et al. (2015)) suffers from the COD, while our IBPF algorithm beats COD consistently across various experiments with different metrics.

In modern highly interconnected power grids, automatic generation control (AGC) is crucial in maintaining the stability of the power grid. The dependence of the AGC system on the information and communications technology (ICT) system makes it vulnerable to various types of cyber-attacks. Thus, information flow (IF) analysis and anomaly detection became paramount for preventing cyber attackers from driving the cyber-physical power system (CPPS) to instability. In this paper, the ICT network traffic rules in CPPSs are explored and the frequency domain features of the ICT network traffic are extracted, basically for developing a robust learning algorithm that can learn the normal traffic pattern based on the ResNeSt convolutional neural network (CNN). Furthermore, to overcome the problem of insufficient abnormal traffic labeled samples, transfer learning approach is used. In the proposed data-driven-based method the deep learning model is trained by traffic frequency features, which makes our model robust against AGC's parameters uncertainties and modeling nonlinearities.

Power systems are prone to a variety of events (e.g. line trips and generation loss) and real-time identification of such events is crucial in terms of situational awareness, reliability, and security. Using measurements from multiple synchrophasors, i.e., phasor measurement units (PMUs), we propose to identify events by extracting features based on modal dynamics. We combine such traditional physics-based feature extraction methods with machine learning to distinguish different event types. Including all measurement channels at each PMU allows exploiting diverse features but also requires learning classification models over a high-dimensional space. To address this issue, various feature selection methods are implemented to choose the best subset of features. Using the obtained subset of features, we investigate the performance of two well-known classification models, namely, logistic regression (LR) and support vector machines (SVM) to identify generation loss and line trip events in two datasets. The first dataset is obtained from simulated generation loss and line trip events in the Texas 2000-bus synthetic grid. The second is a proprietary dataset with labeled events obtained from a large utility in the USA involving measurements from nearly 500 PMUs. Our results indicate that the proposed framework is promising for identifying the two types of events.

Contemporary deep-learning object detection methods for autonomous driving usually assume prefixed categories of common traffic participants, such as pedestrians and cars. Most existing detectors are unable to detect uncommon objects and corner cases (e.g., a dog crossing a street), which may lead to severe accidents in some situations, making the timeline for the real-world application of reliable autonomous driving uncertain. One main reason that impedes the development of truly reliably self-driving systems is the lack of public datasets for evaluating the performance of object detectors on corner cases. Hence, we introduce a challenging dataset named CODA that exposes this critical problem of vision-based detectors. The dataset consists of 1500 carefully selected real-world driving scenes, each containing four object-level corner cases (on average), spanning more than 30 object categories. On CODA, the performance of standard object detectors trained on large-scale autonomous driving datasets significantly drops to no more than 12.8% in mAR. Moreover, we experiment with the state-of-the-art open-world object detector and find that it also fails to reliably identify the novel objects in CODA, suggesting that a robust perception system for autonomous driving is probably still far from reach. We expect our CODA dataset to facilitate further research in reliable detection for real-world autonomous driving. Our dataset will be released at https://coda-dataset.github.io.

Data is a key component of modern machine learning, but statistics for assessing data label quality remain sparse in literature. Here, we introduce DiPietro-Hazari Kappa, a novel statistical metric for assessing the quality of suggested dataset labels in the context of human annotation. Rooted in the classical Fleiss's Kappa measure of inter-annotator agreement, the DiPietro-Hazari Kappa quantifies the the empirical annotator agreement differential that was attained above random chance. We offer a thorough theoretical examination of Fleiss's Kappa before turning to our derivation of DiPietro-Hazari Kappa. Finally, we conclude with a matrix formulation and set of procedural instructions for easy computational implementation.

A protein performs biological functions by folding to a particular 3D structure. To accurately model the protein structures, both the overall geometric topology and local fine-grained relations between amino acids (e.g. side-chain torsion angles and inter-amino-acid orientations) should be carefully considered. In this work, we propose the Directed Weight Neural Network for better capturing geometric relations among different amino acids. Extending a single weight from a scalar to a 3D directed vector, our new framework supports a rich set of geometric operations on both classical and SO(3)--representation features, on top of which we construct a perceptron unit for processing amino-acid information. In addition, we introduce an equivariant message passing paradigm on proteins for plugging the directed weight perceptrons into existing Graph Neural Networks, showing superior versatility in maintaining SO(3)-equivariance at the global scale. Experiments show that our network has remarkably better expressiveness in representing geometric relations in comparison to classical neural networks and the (globally) equivariant networks. It also achieves state-of-the-art performance on various computational biology applications related to protein 3D structures.

The absorption, distribution, metabolism, excretion, and toxicity (ADMET) properties are important in drug discovery as they define efficacy and safety. In this work, we applied an ensemble of features, including fingerprints and descriptors, and a tree-based machine learning model, extreme gradient boosting, for accurate ADMET prediction. Our model performs well in the Therapeutics Data Commons ADMET benchmark group. For 22 tasks, our model is ranked first in 18 tasks and top 3 in 21 tasks. The trained machine learning models are integrated in ADMETboost, a web server that is publicly available at https://ai-druglab.smu.edu/admet.

Vision Transformers (ViTs) have triggered the most recent and significant breakthroughs in computer vision. Their efficient designs are mostly guided by the indirect metric of computational complexity, i.e., FLOPs, which however has a clear gap with the direct metric such as throughput. Thus, we propose to use the direct speed evaluation on the target platform as the design principle for efficient ViTs. Particularly, we introduce LITv2, a simple and effective ViT which performs favourably against the existing state-of-the-art methods across a spectrum of different model sizes with faster speed. At the core of LITv2 is a novel self-attention mechanism, which we dub HiLo. HiLo is inspired by the insight that high frequencies in an image capture local fine details and low frequencies focus on global structures, whereas a multi-head self-attention layer neglects the characteristic of different frequencies. Therefore, we propose to disentangle the high/low frequency patterns in an attention layer by separating the heads into two groups, where one group encodes high frequencies via self-attention within each local window, and another group performs the attention to model the global relationship between the average-pooled low-frequency keys from each window and each query position in the input feature map. Benefiting from the efficient design for both groups, we show that HiLo is superior to the existing attention mechanisms by comprehensively benchmarking FLOPs, speed and memory consumption on GPUs. Powered by HiLo, LITv2 serves as a strong backbone for mainstream vision tasks including image classification, dense detection and segmentation. Code is available at https://github.com/ziplab/LITv2.

Replay methods have shown to be successful in mitigating catastrophic forgetting in continual learning scenarios despite having limited access to historical data. However, storing historical data is cheap in many real-world applications, yet replaying all historical data would be prohibited due to processing time constraints. In such settings, we propose learning the time to learn for a continual learning system, in which we learn replay schedules over which tasks to replay at different time steps. To demonstrate the importance of learning the time to learn, we first use Monte Carlo tree search to find the proper replay schedule and show that it can outperform fixed scheduling policies in terms of continual learning performance. Moreover, to improve the scheduling efficiency itself, we propose to use reinforcement learning to learn the replay scheduling policies that can generalize to new continual learning scenarios without added computational cost. In our experiments, we show the advantages of learning the time to learn, which brings current continual learning research closer to real-world needs.

Decision trees are well-known due to their ease of interpretability. To improve accuracy, we need to grow deep trees or ensembles of trees. These are hard to interpret, offsetting their original benefits. Shapley values have recently become a popular way to explain the predictions of tree-based machine learning models. It provides a linear weighting to features independent of the tree structure. The rise in popularity is mainly due to TreeShap, which solves a general exponential complexity problem in polynomial time. Following extensive adoption in the industry, more efficient algorithms are required. This paper presents a more efficient and straightforward algorithm: Linear TreeShap. Like TreeShap, Linear TreeShap is exact and requires the same amount of memory.

To train deep learning models faster, distributed training on multiple GPUs is the very popular scheme in recent years. However, the communication bandwidth is still a major bottleneck of training performance. To improve overall training performance, recent works have proposed gradient sparsification methods that reduce the communication traffic significantly. Most of them require gradient sorting to select meaningful gradients such as Top-k gradient sparsification (Top-k SGD). However, Top-k SGD has a limit to increase the speed up overall training performance because gradient sorting is significantly inefficient on GPUs. In this paper, we conduct experiments that show the inefficiency of Top-k SGD and provide the insight of the low performance. Based on observations from our empirical analysis, we plan to yield a high performance gradient sparsification method as a future work.

In recent computer vision research, the advent of the Vision Transformer (ViT) has rapidly revolutionized various architectural design efforts: ViT achieved state-of-the-art image classification performance using self-attention found in natural language processing, and MLP-Mixer achieved competitive performance using simple multi-layer perceptrons. In contrast, several studies have also suggested that carefully redesigned convolutional neural networks (CNNs) can achieve advanced performance comparable to ViT without resorting to these new ideas. Against this background, there is growing interest in what inductive bias is suitable for computer vision. Here we propose Sequencer, a novel and competitive architecture alternative to ViT that provides a new perspective on these issues. Unlike ViTs, Sequencer models long-range dependencies using LSTMs rather than self-attention layers. We also propose a two-dimensional version of Sequencer module, where an LSTM is decomposed into vertical and horizontal LSTMs to enhance performance. Despite its simplicity, several experiments demonstrate that Sequencer performs impressively well: Sequencer2D-L, with 54M parameters, realizes 84.6% top-1 accuracy on only ImageNet-1K. Not only that, we show that it has good transferability and the robust resolution adaptability on double resolution-band.

Measuring uncertainties in the output of a deep learning method is useful in several ways, such as in assisting with interpretation of the outputs, helping build confidence with end users, and for improving the training and performance of the networks. Several different methods have been proposed to estimate uncertainties, including those from epistemic (relating to the model used) and aleatoric (relating to the data) sources using test-time dropout and augmentation, respectively. Not only are these uncertainty sources different, but they are governed by parameter settings (e.g., dropout rate or type and level of augmentation) that establish even more distinct uncertainty categories. This work investigates how different the uncertainties are from these categories, for magnitude and spatial pattern, to empirically address the question of whether they provide usefully distinct information that should be captured whenever uncertainties are used. We take the well characterised BraTS challenge dataset to demonstrate that there are substantial differences in both magnitude and spatial pattern of uncertainties from the different categories, and discuss the implications of these in various use cases.

Tensor decompositions are powerful tools for dimensionality reduction and feature interpretation of multidimensional data such as signals. Existing tensor decomposition objectives (e.g., Frobenius norm) are designed for fitting raw data under statistical assumptions, which may not align with downstream classification tasks. In practice, raw input tensors can contain irrelevant information while data augmentation techniques may be used to smooth out class-irrelevant noise in samples. This paper addresses the above challenges by proposing augmented tensor decomposition (ATD), which effectively incorporates data augmentations and self-supervised learning (SSL) to boost downstream classification. To address the non-convexity of the new augmented objective, we develop an iterative method that enables the optimization to follow an alternating least squares (ALS) fashion. We evaluate our proposed ATD on multiple datasets. It can achieve 0.8% - 2.5% accuracy gain over tensor-based baselines. Also, our ATD model shows comparable or better performance (e.g., up to 15% in accuracy) over self-supervised and autoencoder baselines while using less than 5% of learnable parameters of these baseline models

Node classification is an important task in graph neural networks, but most existing studies assume that samples from different classes are balanced. However, the class imbalance problem is widespread and can seriously affect the model's performance. Reducing the adverse effects of imbalanced datasets on model training is crucial to improve the model's performance. Therefore, a new loss function FD-Loss is reconstructed based on the traditional algorithm-level approach to the imbalance problem. Firstly, we propose sample mismeasurement distance to filter edge-hard samples and simple samples based on the distribution. Then, the weight coefficients are defined based on the mismeasurement distance and used in the loss function weighting term, so that the loss function focuses only on valuable samples. Experiments on several benchmarks demonstrate that our loss function can effectively solve the sample node imbalance problem and improve the classification accuracy by 4% compared to existing methods in the node classification task.

Deep-learning models have enabled performance leaps in analysis of high-dimensional functional MRI (fMRI) data. Yet, many previous methods are suboptimally sensitive for contextual representations across diverse time scales. Here, we present BolT, a blood-oxygen-level-dependent transformer model, for analyzing multi-variate fMRI time series. BolT leverages a cascade of transformer encoders equipped with a novel fused window attention mechanism. Encoding is performed on temporally-overlapped windows within the time series to capture local representations. To integrate information temporally, cross-window attention is computed between base tokens in each window and fringe tokens from neighboring windows. To gradually transition from local to global representations, the extent of window overlap and thereby number of fringe tokens are progressively increased across the cascade. Finally, a novel cross-window regularization is employed to align high-level classification features across the time series. Comprehensive experiments on large-scale public datasets demonstrate the superior performance of BolT against state-of-the-art methods. Furthermore, explanatory analyses to identify landmark time points and regions that contribute most significantly to model decisions corroborate prominent neuroscientific findings in the literature.

The convolutional neural networks (CNNs) are generally trained using stochastic gradient descent (SGD) based optimization techniques. The existing SGD optimizers generally suffer with the overshooting of the minimum and oscillation near minimum. In this paper, we propose a new approach, hereafter referred as AdaInject, for the gradient descent optimizers by injecting the second order moment into the first order moment. Specifically, the short-term change in parameter is used as a weight to inject the second order moment in the update rule. The AdaInject optimizer controls the parameter update, avoids the overshooting of the minimum and reduces the oscillation near minimum. The proposed approach is generic in nature and can be integrated with any existing SGD optimizer. The effectiveness of the AdaInject optimizer is explained intuitively as well as through some toy examples. We also show the convergence property of the proposed injection based optimizer. Further, we depict the efficacy of the AdaInject approach through extensive experiments in conjunction with the state-of-the-art optimizers, namely AdamInject, diffGradInject, RadamInject, and AdaBeliefInject on four benchmark datasets. Different CNN models are used in the experiments. A highest improvement in the top-1 classification error rate of $16.54\%$ is observed using diffGradInject optimizer with ResNeXt29 model over the CIFAR10 dataset. Overall, we observe very promising performance improvement of existing optimizers with the proposed AdaInject approach. The code is available at: \url{https://github.com/shivram1987/AdaInject}.

We design fast algorithms for repeatedly sampling from strongly Rayleigh distributions, which include random spanning tree distributions and determinantal point processes. For a graph $G=(V, E)$, we show how to approximately sample uniformly random spanning trees from $G$ in $\widetilde{O}(\lvert V\rvert)$ time per sample after an initial $\widetilde{O}(\lvert E\rvert)$ time preprocessing. For a determinantal point process on subsets of size $k$ of a ground set of $n$ elements, we show how to approximately sample in $\widetilde{O}(k^\omega)$ time after an initial $\widetilde{O}(nk^{\omega-1})$ time preprocessing, where $\omega<2.372864$ is the matrix multiplication exponent. We even improve the state of the art for obtaining a single sample from determinantal point processes, from the prior runtime of $\widetilde{O}(\min\{nk^2, n^\omega\})$ to $\widetilde{O}(nk^{\omega-1})$. In our main technical result, we achieve the optimal limit on domain sparsification for strongly Rayleigh distributions. In domain sparsification, sampling from a distribution $\mu$ on $\binom{[n]}{k}$ is reduced to sampling from related distributions on $\binom{[t]}{k}$ for $t\ll n$. We show that for strongly Rayleigh distributions, we can can achieve the optimal $t=\widetilde{O}(k)$. Our reduction involves sampling from $\widetilde{O}(1)$ domain-sparsified distributions, all of which can be produced efficiently assuming convenient access to approximate overestimates for marginals of $\mu$. Having access to marginals is analogous to having access to the mean and covariance of a continuous distribution, or knowing "isotropy" for the distribution, the key assumption behind the Kannan-Lov\'asz-Simonovits (KLS) conjecture and optimal samplers based on it. We view our result as a moral analog of the KLS conjecture and its consequences for sampling, for discrete strongly Rayleigh measures.

Learning sketching matrices for fast and accurate low-rank approximation (LRA) has gained increasing attention. Recently, Bartlett, Indyk, and Wagner (COLT 2022) presented a generalization bound for the learning-based LRA. Specifically, for rank-$k$ approximation using an $m \times n$ learned sketching matrix with $s$ non-zeros in each column, they proved an $\tilde{\mathrm{O}}(nsm)$ bound on the \emph{fat shattering dimension} ($\tilde{\mathrm{O}}$ hides logarithmic factors). We build on their work and make two contributions. 1. We present a better $\tilde{\mathrm{O}}(nsk)$ bound ($k \le m$). En route to obtaining the bound, we give a low-complexity \emph{Goldberg--Jerrum algorithm} for computing pseudo-inverse matrices, which would be of independent interest. 2. We alleviate an assumption of the previous study that the sparsity pattern of sketching matrices is fixed. We prove that learning positions of non-zeros increases the fat shattering dimension only by ${\mathrm{O}}(ns\log n)$. Also, experiments confirm the practical benefit of learning sparsity patterns.

While many multi-robot coordination problems can be solved optimally by exact algorithms, solutions are often not scalable in the number of robots. Multi-Agent Reinforcement Learning (MARL) is gaining increasing attention in the robotics community as a promising solution to tackle such problems. Nevertheless, we still lack the tools that allow us to quickly and efficiently find solutions to large-scale collective learning tasks. In this work, we introduce the Vectorized Multi-Agent Simulator (VMAS). VMAS is an open-source framework designed for efficient MARL benchmarking. It is comprised of a vectorized 2D physics engine written in PyTorch and a set of twelve challenging multi-robot scenarios. Additional scenarios can be implemented through a simple and modular interface. We demonstrate how vectorization enables parallel simulation on accelerated hardware without added complexity. When comparing VMAS to OpenAI MPE, we show how MPE's execution time increases linearly in the number of simulations while VMAS is able to execute 30,000 parallel simulations in under 10s, proving more than 100x faster. Using VMAS's RLlib interface, we benchmark our multi-robot scenarios using various Proximal Policy Optimization (PPO)-based MARL algorithms. VMAS's scenarios prove challenging in orthogonal ways for state-of-the-art MARL algorithms. The VMAS framework is available at https://github.com/proroklab/VectorizedMultiAgentSimulator. A video of VMAS scenarios and experiments is available at https://youtu.be/aaDRYfiesAY.

In our multicultural world, affect-aware AI systems that support humans need the ability to perceive affect across variations in emotion expression patterns across cultures. These systems must perform well in cultural contexts without annotated affect datasets available for training models. A standard assumption in affective computing is that affect recognition models trained and used within the same culture (intracultural) will perform better than models trained on one culture and used on different cultures (intercultural). We test this assumption and present the first systematic study of intercultural affect recognition models using videos of real-world dyadic interactions from six cultures. We develop an attention-based feature selection approach under temporal causal discovery to identify behavioral cues that can be leveraged in intercultural affect recognition models. Across all six cultures, our findings demonstrate that intercultural affect recognition models were as effective or more effective than intracultural models. We identify and contribute useful behavioral features for intercultural affect recognition; facial features from the visual modality were more useful than the audio modality in this study's context. Our paper presents a proof-of-concept and motivation for the future development of intercultural affect recognition systems, especially those deployed in low-resource situations without annotated data.

Both in academic and industry-based research, online evaluation methods are seen as the golden standard for interactive applications like recommendation systems. Naturally, the reason for this is that we can directly measure utility metrics that rely on interventions, being the recommendations that are being shown to users. Nevertheless, online evaluation methods are costly for a number of reasons, and a clear need remains for reliable offline evaluation procedures. In industry, offline metrics are often used as a first-line evaluation to generate promising candidate models to evaluate online. In academic work, limited access to online systems makes offline metrics the de facto approach to validating novel methods. Two classes of offline metrics exist: proxy-based methods, and counterfactual methods. The first class is often poorly correlated with the online metrics we care about, and the latter class only provides theoretical guarantees under assumptions that cannot be fulfilled in real-world environments. Here, we make the case that simulation-based comparisons provide ways forward beyond offline metrics, and argue that they are a preferable means of evaluation.

Deep Reinforcement Learning (DRL) algorithms can scale to previously intractable problems. The automation of profit generation in the stock market is possible using DRL, by combining the financial assets price "prediction" step and the "allocation" step of the portfolio in one unified process to produce fully autonomous systems capable of interacting with their environment to make optimal decisions through trial and error. This work represents a DRL model to generate profitable trades in the stock market, effectively overcoming the limitations of supervised learning approaches. We formulate the trading problem as a Partially Observed Markov Decision Process (POMDP) model, considering the constraints imposed by the stock market, such as liquidity and transaction costs. We then solve the formulated POMDP problem using the Twin Delayed Deep Deterministic Policy Gradient (TD3) algorithm reporting a 2.68 Sharpe Ratio on unseen data set (test data). From the point of view of stock market forecasting and the intelligent decision-making mechanism, this paper demonstrates the superiority of DRL in financial markets over other types of machine learning and proves its credibility and advantages of strategic decision-making.

Development of an accurate, flexible, and numerically efficient uncertainty quantification (UQ) method is one of fundamental challenges in machine learning. Previously, a UQ method called DISCO Nets has been proposed (Bouchacourt et al., 2016) that trains a neural network by minimizing the so-called energy score on training data. This method has shown superior performance on a hand pose estimation task in computer vision, but it remained unclear whether this method works as nicely for regression on tabular data, and how it competes with more recent advanced UQ methods such as NGBoost. In this paper, we propose an improved neural architecture of DISCO Nets that admits a more stable and smooth training. We benchmark this approach on miscellaneous real-world tabular datasets and confirm that it is competitive with or even superior to standard UQ baselines. We also provide a new elementary proof for the validity of using the energy score to learn predictive distributions. Further, we point out that DISCO Nets in its original form ignore epistemic uncertainty and only capture aleatoric uncertainty. We propose a simple fix to this problem.

Meta-learning is a branch of machine learning which trains neural network models to synthesize a wide variety of data in order to rapidly solve new problems. In process control, many systems have similar and well-understood dynamics, which suggests it is feasible to create a generalizable controller through meta-learning. In this work, we formulate a meta reinforcement learning (meta-RL) control strategy that can be used to tune proportional--integral controllers. Our meta-RL agent has a recurrent structure that accumulates "context" to learn a system's dynamics through a hidden state variable in closed-loop. This architecture enables the agent to automatically adapt to changes in the process dynamics. In tests reported here, the meta-RL agent was trained entirely offline on first order plus time delay systems, and produced excellent results on novel systems drawn from the same distribution of process dynamics used for training. A key design element is the ability to leverage model-based information offline during training in simulated environments while maintaining a model-free policy structure for interacting with novel processes where there is uncertainty regarding the true process dynamics. Meta-learning is a promising approach for constructing sample-efficient intelligent controllers.

We provide a decision theoretic analysis of bandit experiments. Working within the framework of diffusion asymptotics, we define suitable notions of asymptotic Bayes and minimax risk for these experiments. For normally distributed rewards, the minimal Bayes risk can be characterized as the solution to a second-order partial differential equation (PDE). Using a limit of experiments approach, we show that this PDE characterization also holds asymptotically under both parametric and non-parametric distributions of the rewards. The approach further describes the state variables it is asymptotically sufficient to restrict attention to, and thereby suggests a practical strategy for dimension reduction. The PDEs characterizing minimal Bayes risk can be solved efficiently using sparse matrix routines. We derive the optimal Bayes and minimax policies from their numerical solutions. These optimal policies substantially dominate existing methods such as Thompson sampling and UCB, often by a factor of two. The framework also covers time discounting and pure exploration.

Federated learning learns a neural network model by aggregating the knowledge from a group of distributed clients under the privacy-preserving constraint. In this work, we show that this paradigm might inherit the adversarial vulnerability of the centralized neural network, i.e., it has deteriorated performance on adversarial examples when the model is deployed. This is even more alarming when federated learning paradigm is designed to approximate the updating behavior of a centralized neural network. To solve this problem, we propose an adversarially robust federated learning framework, named Fed_BVA, with improved server and client update mechanisms. This is motivated by our observation that the generalization error in federated learning can be naturally decomposed into the bias and variance triggered by multiple clients' predictions. Thus, we propose to generate the adversarial examples via maximizing the bias and variance during server update, and learn the adversarially robust model updates with those examples during client update. As a result, an adversarially robust neural network can be aggregated from these improved local clients' model updates. The experiments are conducted on multiple benchmark data sets using several prevalent neural network models, and the empirical results show that our framework is robust against white-box and black-box adversarial corruptions under both IID and non-IID settings.

In the pursuit of explaining implicit regularization in deep learning, prominent focus was given to matrix and tensor factorizations, which correspond to simplified neural networks. It was shown that these models exhibit an implicit tendency towards low matrix and tensor ranks, respectively. Drawing closer to practical deep learning, the current paper theoretically analyzes the implicit regularization in hierarchical tensor factorization, a model equivalent to certain deep convolutional neural networks. Through a dynamical systems lens, we overcome challenges associated with hierarchy, and establish implicit regularization towards low hierarchical tensor rank. This translates to an implicit regularization towards locality for the associated convolutional networks. Inspired by our theory, we design explicit regularization discouraging locality, and demonstrate its ability to improve the performance of modern convolutional networks on non-local tasks, in defiance of conventional wisdom by which architectural changes are needed. Our work highlights the potential of enhancing neural networks via theoretical analysis of their implicit regularization.

Deep learning is a standard tool in the field of high-energy physics, facilitating considerable sensitivity enhancements for numerous analysis strategies. In particular, in identification of physics objects, such as jet flavor tagging, complex neural network architectures play a major role. However, these methods are reliant on accurate simulations. Mismodeling can lead to non-negligible differences in performance in data that need to be measured and calibrated against. We investigate the classifier response to input data with injected mismodelings and probe the vulnerability of flavor tagging algorithms via application of adversarial attacks. Subsequently, we present an adversarial training strategy that mitigates the impact of such simulated attacks and improves the classifier robustness. We examine the relationship between performance and vulnerability and show that this method constitutes a promising approach to reduce the vulnerability to poor modeling.

Minority groups have been using social media to organize social movements that create profound social impacts. Black Lives Matter (BLM) and Stop Asian Hate (SAH) are two successful social movements that have spread on Twitter that promote protests and activities against racism and increase the public's awareness of other social challenges that minority groups face. However, previous studies have mostly conducted qualitative analyses of tweets or interviews with users, which may not comprehensively and validly represent all tweets. Very few studies have explored the Twitter topics within BLM and SAH dialogs in a rigorous, quantified and data-centered approach. Therefore, in this research, we adopted a mixed-methods approach to comprehensively analyze BLM and SAH Twitter topics. We implemented (1) the latent Dirichlet allocation model to understand the top high-level words and topics and (2) open-coding analysis to identify specific themes across the tweets. We collected more than one million tweets with the #blacklivesmatter and #stopasianhate hashtags and compared their topics. Our findings revealed that the tweets discussed a variety of influential topics in depth, and social justice, social movements, and emotional sentiments were common topics in both movements, though with unique subtopics for each movement. Our study contributes to the topic analysis of social movements on social media platforms in particular and the literature on the interplay of AI, ethics, and society in general.

We study methods for task-agnostic continual reinforcement learning (TACRL). TACRL is a setting that combines the difficulties of partially-observable RL (a consequence of task agnosticism) and the difficulties of continual learning (CL), i.e., learning on a non-stationary sequence of tasks. We compare TACRL methods with their soft upper bounds prescribed by previous literature: multi-task learning (MTL) methods which do not have to deal with non-stationary data distributions, as well as task-aware methods, which are allowed to operate under full observability. We consider a previously unexplored and straightforward baseline for TACRL, replay-based recurrent RL (3RL), in which we augment an RL algorithm with recurrent mechanisms to mitigate partial observability and experience replay mechanisms for catastrophic forgetting in CL. By studying empirical performance in a sequence of RL tasks, we find surprising occurrences of 3RL matching and overcoming the MTL and task-aware soft upper bounds. We lay out hypotheses that could explain this inflection point of continual and task-agnostic learning research. Our hypotheses are empirically tested in continuous control tasks via a large-scale study of the popular multi-task and continual learning benchmark Meta-World. By analyzing different training statistics including gradient conflict, we find evidence that 3RL's outperformance stems from its ability to quickly infer how new tasks relate with the previous ones, enabling forward transfer.

If the trend of learned components eventually outperforming their hand-crafted version continues, learned optimizers will eventually outperform hand-crafted optimizers like SGD or Adam. Even if learned optimizers (L2Os) eventually outpace hand-crafted ones in practice however, they are still not provably convergent and might fail out of distribution. These are the questions addressed here. Currently, learned optimizers frequently outperform generic hand-crafted optimizers (such as gradient descent) at the beginning of learning but they generally plateau after some time while the generic algorithms continue to make progress and often overtake the learned algorithm as Aesop's tortoise which overtakes the hare. L2Os also still have a difficult time generalizing out of distribution. Heaton et al. proposed Safeguarded L2O (GL2O) which can take a learned optimizer and safeguard it with a generic learning algorithm so that by conditionally switching between the two, the resulting algorithm is provably convergent. We propose a new class of Safeguarded L2O, called Loss-Guarded L2O (LGL2O), which is both conceptually simpler and computationally less expensive. The guarding mechanism decides solely based on the expected future loss value of both optimizers. Furthermore, we show theoretical proof of LGL2O's convergence guarantee and empirical results comparing to GL2O and other baselines showing that it combines the best of both L2O and SGD and that in practice converges much better than GL2O.

With model trustworthiness being crucial for sensitive real-world applications, practitioners are putting more and more focus on improving the uncertainty calibration of deep neural networks. Calibration errors are designed to quantify the reliability of probabilistic predictions but their estimators are usually biased and inconsistent. In this work, we introduce the framework of proper calibration errors, which relates every calibration error to a proper score and provides a respective upper bound with optimal estimation properties. This relationship can be used to reliably quantify the model calibration improvement. We theoretically and empirically demonstrate the shortcomings of commonly used estimators compared to our approach. Due to the wide applicability of proper scores, this gives a natural extension of recalibration beyond classification.

We hypothesize that due to the greedy nature of learning in multi-modal deep neural networks, these models tend to rely on just one modality while under-fitting the other modalities. Such behavior is counter-intuitive and hurts the models' generalization, as we observe empirically. To estimate the model's dependence on each modality, we compute the gain on the accuracy when the model has access to it in addition to another modality. We refer to this gain as the conditional utilization rate. In the experiments, we consistently observe an imbalance in conditional utilization rates between modalities, across multiple tasks and architectures. Since conditional utilization rate cannot be computed efficiently during training, we introduce a proxy for it based on the pace at which the model learns from each modality, which we refer to as the conditional learning speed. We propose an algorithm to balance the conditional learning speeds between modalities during training and demonstrate that it indeed addresses the issue of greedy learning. The proposed algorithm improves the model's generalization on three datasets: Colored MNIST, ModelNet40, and NVIDIA Dynamic Hand Gesture.

Over the last two decades, the robotics community witnessed the emergence of various motion representations that have been used extensively, particularly in behavorial cloning, to compactly encode and generalize skills. Among these, probabilistic approaches have earned a relevant place, owing to their encoding of variations, correlations and adaptability to new task conditions. Modulating such primitives, however, is often cumbersome due to the need for parameter re-optimization which frequently entails computationally costly operations. In this paper we derive a non-parametric movement primitive formulation that contains a null space projector. We show that such formulation allows for fast and efficient motion generation with computational complexity O(n2) without involving matrix inversions, whose complexity is O(n3). This is achieved by using the null space to track secondary targets, with a precision determined by the training dataset. Using a 2D example associated with time input we show that our non-parametric solution compares favourably with a state-of-the-art parametric approach. For demonstrated skills with high-dimensional inputs we show that it permits on-the-fly adaptation as well.

Although machine learning on hypergraphs has attracted considerable attention, most of the works have focused on (semi-)supervised learning, which may cause heavy labeling costs and poor generalization. Recently, contrastive learning has emerged as a successful unsupervised representation learning method. Despite the prosperous development of contrastive learning in other domains, contrastive learning on hypergraphs remains little explored. In this paper, we propose TriCL (Tri-directional Contrastive Learning), a general framework for contrastive learning on hypergraphs. Its main idea is tri-directional contrast, and specifically, it aims to maximize in two augmented views the agreement (a) between the same node, (b) between the same group of nodes, and (c) between each group and its members. Together with simple but surprisingly effective data augmentation and negative sampling schemes, these three forms of contrast enable TriCL to capture both microscopic and mesoscopic structural information in node embeddings. Our extensive experiments using 13 baseline approaches, five datasets, and two tasks demonstrate the effectiveness of TriCL, and most noticeably, TriCL consistently outperforms not just unsupervised competitors but also (semi-)supervised competitors mostly by significant margins for node classification.

It is now a standard for neural network representations to be trained on large, publicly available datasets, and used for new problems. The reasons for why neural network representations have been so successful for transfer, however, are still not fully understood. In this paper we show that, after training, neural network representations align their top singular vectors to the targets. We investigate this representation alignment phenomenon in a variety of neural network architectures and find that (a) alignment emerges across a variety of different architectures and optimizers, with more alignment arising from depth (b) alignment increases for layers closer to the output and (c) existing high-performance deep CNNs exhibit high levels of alignment. We then highlight why alignment between the top singular vectors and the targets can speed up learning and show in a classic synthetic transfer problem that representation alignment correlates with positive and negative transfer to similar and dissimilar tasks.

The data article describes the Road Damage Dataset, RDD2022, which comprises 47,420 road images from six countries, Japan, India, the Czech Republic, Norway, the United States, and China. The images have been annotated with more than 55,000 instances of road damage. Four types of road damage, namely longitudinal cracks, transverse cracks, alligator cracks, and potholes, are captured in the dataset. The annotated dataset is envisioned for developing deep learning-based methods to detect and classify road damage automatically. The dataset has been released as a part of the Crowd sensing-based Road Damage Detection Challenge (CRDDC2022). The challenge CRDDC2022 invites researchers from across the globe to propose solutions for automatic road damage detection in multiple countries. The municipalities and road agencies may utilize the RDD2022 dataset, and the models trained using RDD2022 for low-cost automatic monitoring of road conditions. Further, computer vision and machine learning researchers may use the dataset to benchmark the performance of different algorithms for other image-based applications of the same type (classification, object detection, etc.).

Learning effective protein representations is critical in a variety of tasks in biology such as predicting protein function or structure. Existing approaches usually pretrain protein language models on a large number of unlabeled amino acid sequences and then finetune the models with some labeled data in downstream tasks. Despite the effectiveness of sequence-based approaches, the power of pretraining on known protein structures, which are available in smaller numbers only, has not been explored for protein property prediction, though protein structures are known to be determinants of protein function. In this paper, we propose to pretrain protein representations according to their 3D structures. We first present a simple yet effective encoder to learn the geometric features of a protein. We pretrain the protein graph encoder by leveraging multiview contrastive learning and different self-prediction tasks. Experimental results on both function prediction and fold classification tasks show that our proposed pretraining methods outperform or are on par with the state-of-the-art sequence-based methods, while using much less data. Our implementation is available at https://github.com/DeepGraphLearning/GearNet.

Low-rank tensor completion (LRTC) is an important problem in computer vision and machine learning. The minimax-concave penalty (MCP) function as a non-convex relaxation has achieved good results in the LRTC problem. To makes all the constant parameters of the MCP function as variables so that futherly improving the adaptability to the change of singular values in the LRTC problem, we propose the bivariate equivalent minimax-concave penalty (BEMCP) theorem. Applying the BEMCP theorem to tensor singular values leads to the bivariate equivalent weighted tensor $\Gamma$-norm (BEWTGN) theorem, and we analyze and discuss its corresponding properties. Besides, to facilitate the solution of the LRTC problem, we give the proximal operators of the BEMCP theorem and BEWTGN. Meanwhile, we propose a BEMCP model for the LRTC problem, which is optimally solved based on alternating direction multiplier (ADMM). Finally, the proposed method is applied to the data restorations of multispectral image (MSI), magnetic resonance imaging (MRI) and color video (CV) in real-world, and the experimental results demonstrate that it outperforms the state-of-arts methods.

Class imbalance poses a major challenge for machine learning as most supervised learning models might exhibit bias towards the majority class and under-perform in the minority class. Cost-sensitive learning tackles this problem by treating the classes differently, formulated typically via a user-defined fixed misclassification cost matrix provided as input to the learner. Such parameter tuning is a challenging task that requires domain knowledge and moreover, wrong adjustments might lead to overall predictive performance deterioration. In this work, we propose a novel cost-sensitive boosting approach for imbalanced data that dynamically adjusts the misclassification costs over the boosting rounds in response to model's performance instead of using a fixed misclassification cost matrix. Our method, called AdaCC, is parameter-free as it relies on the cumulative behavior of the boosting model in order to adjust the misclassification costs for the next boosting round and comes with theoretical guarantees regarding the training error. Experiments on 27 real-world datasets from different domains with high class imbalance demonstrate the superiority of our method over 12 state-of-the-art cost-sensitive boosting approaches exhibiting consistent improvements in different measures, for instance, in the range of [0.3%-28.56%] for AUC, [3.4%-21.4%] for balanced accuracy, [4.8%-45%] for gmean and [7.4%-85.5%] for recall.

Quantum computing is expected to have transformative influences on many domains, but its practical deployments on industry problems are underexplored. We focus on applying quantum computing to operations management problems in industry, and in particular, supply chain management. Many problems in supply chain management involve large state and action spaces and pose computational challenges on classic computers. We develop a quantized policy iteration algorithm to solve an inventory control problem and demonstrative its effectiveness. We also discuss in-depth the hardware requirements and potential challenges on implementing this quantum algorithm in the near term. Our simulations and experiments are powered by the IBM Qiskit and the qBraid system.

Evaluating robustness of machine-learning models to adversarial examples is a challenging problem. Many defenses have been shown to provide a false sense of robustness by causing gradient-based attacks to fail, and they have been broken under more rigorous evaluations. Although guidelines and best practices have been suggested to improve current adversarial robustness evaluations, the lack of automatic testing and debugging tools makes it difficult to apply these recommendations in a systematic manner. In this work, we overcome these limitations by: (i) categorizing attack failures based on how they affect the optimization of gradient-based attacks, while also unveiling two novel failures affecting many popular attack implementations and past evaluations; (ii) proposing six novel indicators of failure, to automatically detect the presence of such failures in the attack optimization process; and (iii) suggesting a systematic protocol to apply the corresponding fixes. Our extensive experimental analysis, involving more than 15 models in 3 distinct application domains, shows that our indicators of failure can be used to debug and improve current adversarial robustness evaluations, thereby providing a first concrete step towards automatizing and systematizing them. Our open-source code is available at: https://github.com/pralab/IndicatorsOfAttackFailure.

The task of out-of-distribution (OOD) detection is crucial for deploying machine learning models in real-world settings. In this paper, we observe that the singular value distributions of the in-distribution (ID) and OOD features are quite different: the OOD feature matrix tends to have a larger dominant singular value than the ID feature, and the class predictions of OOD samples are largely determined by it. This observation motivates us to propose \texttt{RankFeat}, a simple yet effective \texttt{post hoc} approach for OOD detection by removing the rank-1 matrix composed of the largest singular value and the associated singular vectors from the high-level feature (\emph{i.e.,} $\mathbf{X}{-} \mathbf{s}_{1}\mathbf{u}_{1}\mathbf{v}_{1}^{T}$). \texttt{RankFeat} achieves the \emph{state-of-the-art} performance and reduces the average false positive rate (FPR95) by 17.90\% compared with the previous best method. Extensive ablation studies and comprehensive theoretical analyses are presented to support the empirical results.

Many applications such as hiring and university admissions involve evaluation and selection of applicants. These tasks are fundamentally difficult, and require combining evidence from multiple different aspects (what we term "attributes"). In these applications, the number of applicants is often large, and a common practice is to assign the task to multiple evaluators in a distributed fashion. Specifically, in the often-used holistic allocation, each evaluator is assigned a subset of the applicants, and is asked to assess all relevant information for their assigned applicants. However, such an evaluation process is subject to issues such as miscalibration (evaluators see only a small fraction of the applicants and may not get a good sense of relative quality), and discrimination (evaluators are influenced by irrelevant information about the applicants). We identify that such attribute-based evaluation allows alternative allocation schemes. Specifically, we consider assigning each evaluator more applicants but fewer attributes per applicant, termed segmented allocation. We compare segmented allocation to holistic allocation on several dimensions via theoretical and experimental methods. We establish various tradeoffs between these two approaches, and identify conditions under which one approach results in more accurate evaluation than the other.

The paper describes neural models developed for the DAGPap22 shared task hosted at the Third Workshop on Scholarly Document Processing. This shared task targets the automatic detection of generated scientific papers. Our work focuses on comparing different transformer-based models as well as using additional datasets and techniques to deal with imbalanced classes. As a final submission, we utilized an ensemble of SciBERT, RoBERTa, and DeBERTa fine-tuned using random oversampling technique. Our model achieved 99.24% in terms of F1-score. The official evaluation results have put our system at the third place.

Despite recent studies on understanding deep neural networks (DNNs), there exists numerous questions on how DNNs generate their predictions. Especially, given similar predictions on different input samples, are the underlying mechanisms generating those predictions the same? In this work, we propose NeuCEPT, a method to locally discover critical neurons that play a major role in the model's predictions and identify model's mechanisms in generating those predictions. We first formulate a critical neurons identification problem as maximizing a sequence of mutual-information objectives and provide a theoretical framework to efficiently solve for critical neurons while keeping the precision under control. NeuCEPT next heuristically learns different model's mechanisms in an unsupervised manner. Our experimental results show that neurons identified by NeuCEPT not only have strong influence on the model's predictions but also hold meaningful information about model's mechanisms.

Outlier detection (OD) is a key learning task for finding rare and deviant data samples, with many time-critical applications such as fraud detection and intrusion detection. In this work, we propose TOD, the first tensor-based system for efficient and scalable outlier detection on distributed multi-GPU machines. A key idea behind TOD is decomposing complex OD applications into a small collection of basic tensor algebra operators. This decomposition enables TOD to accelerate OD computations by leveraging recent advances in deep learning infrastructure in both hardware and software. Moreover, to deploy memory-intensive OD applications on modern GPUs with limited on-device memory, we introduce two key techniques. First, provable quantization speeds up OD computations and reduces its memory footprint by automatically performing specific floating-point operations in lower precision while provably guaranteeing no accuracy loss. Second, to exploit the aggregated compute resources and memory capacity of multiple GPUs, we introduce automatic batching, which decomposes OD computations into small batches for both sequential execution on a single GPU and parallel execution on multiple GPUs. TOD supports a diverse set of OD algorithms. Extensive evaluation on 11 real and 3 synthetic OD datasets shows that TOD is on average 10.9x faster than the leading CPU-based OD system PyOD (with a maximum speedup of 38.9x), and can handle much larger datasets than existing GPU-based OD systems. In addition, TOD allows easy integration of new OD operators, enabling fast prototyping of emerging and yet-to-discovered OD algorithms.

Deep-learning-based hyperspectral image (HSI) restoration methods have gained great popularity for their remarkable performance but often demand expensive network retraining whenever the specifics of task changes. In this paper, we propose to restore HSIs in a unified approach with an effective plug-and-play method, which can jointly retain the flexibility of optimization-based methods and utilize the powerful representation capability of deep neural networks. Specifically, we first develop a new deep HSI denoiser leveraging gated recurrent convolution units, short- and long-term skip connections, and an augmented noise level map to better exploit the abundant spatio-spectral information within HSIs. It, therefore, leads to the state-of-the-art performance on HSI denoising under both Gaussian and complex noise settings. Then, the proposed denoiser is inserted into the plug-and-play framework as a powerful implicit HSI prior to tackle various HSI restoration tasks. Through extensive experiments on HSI super-resolution, compressed sensing, and inpainting, we demonstrate that our approach often achieves superior performance, which is competitive with or even better than the state-of-the-art on each task, via a single model without any task-specific training.

The autism dataset is studied to identify the differences between autistic and healthy groups. For this, the resting-state Functional Magnetic Resonance Imaging (rs-fMRI) data of the two groups are analyzed, and networks of connections between brain regions were created. Several classification frameworks are developed to distinguish the connectivity patterns between the groups. The best models for statistical inference and precision were compared, and the tradeoff between precision and model interpretability was analyzed. Finally, the classification accuracy measures were reported to justify the performance of our framework. Our best model can classify autistic and healthy patients on the multisite ABIDE I data with 71% accuracy.

Most of the existing algorithms for zero-shot classification problems typically rely on the attribute-based semantic relations among categories to realize the classification of novel categories without observing any of their instances. However, training the zero-shot classification models still requires attribute labeling for each class (or even instance) in the training dataset, which is also expensive. To this end, in this paper, we bring up a new problem scenario: "Can we derive zero-shot learning for novel attribute detectors/classifiers and use them to automatically annotate the dataset for labeling efficiency?". Basically, given only a small set of detectors that are learned to recognize some manually annotated attributes (i.e., the seen attributes), we aim to synthesize the detectors of novel attributes in a zero-shot learning manner. Our proposed method, Zero-Shot Learning for Attributes (ZSLA), which is the first of its kind to the best of our knowledge, tackles this new research problem by applying the set operations to first decompose the seen attributes into their basic attributes and then recombine these basic attributes into the novel ones. Extensive experiments are conducted to verify the capacity of our synthesized detectors for accurately capturing the semantics of the novel attributes and show their superior performance in terms of detection and localization compared to other baseline approaches. Moreover, we demonstrate the application of automatic annotation using our synthesized detectors on Caltech-UCSD Birds-200-2011 dataset. Various generalized zero-shot classification algorithms trained upon the dataset re-annotated by ZSLA show comparable performance with those trained with the manual ground-truth annotations. Please refer to our project page for source code: https://yuhsuanli.github.io/ZSLA/

Recommender systems, which offer personalized suggestions to users, power many of today's social media, e-commerce and entertainment. However, these systems have been known to intellectually isolate users from a variety of perspectives, or cause filter bubbles. In our work, we characterize and mitigate this filter bubble effect. We do so by classifying various datapoints based on their user-item interaction history and calculating the influences of the classified categories on each other using the well known TracIn method. Finally, we mitigate this filter bubble effect without compromising accuracy by carefully retraining our recommender system.

In the last few years, many explanation methods based on the perturbations of input data have been introduced to improve our understanding of decisions made by black-box models. The goal of this work is to introduce a novel perturbation scheme so that more faithful and robust explanations can be obtained. Our study focuses on the impact of perturbing directions on the data topology. We show that perturbing along the orthogonal directions of the input manifold better preserves the data topology, both in the worst-case analysis of the discrete Gromov-Hausdorff distance and in the average-case analysis via persistent homology. From those results, we introduce EMaP algorithm, realizing the orthogonal perturbation scheme. Our experiments show that EMaP not only improves the explainers' performance but also helps them overcome a recently-developed attack against perturbation-based methods.

Conventional works generally employ a two-phase model in which a generator selects the most important pieces, followed by a predictor that makes predictions based on the selected pieces. However, such a two-phase model may incur the degeneration problem where the predictor overfits to the noise generated by a not yet well-trained generator and in turn, leads the generator to converge to a sub-optimal model that tends to select senseless pieces. To tackle this challenge, we propose Folded Rationalization (FR) that folds the two phases of the rationale model into one from the perspective of text semantic extraction. The key idea of FR is to employ a unified encoder between the generator and predictor, based on which FR can facilitate a better predictor by access to valuable information blocked by the generator in the traditional two-phase model and thus bring a better generator. Empirically, we show that FR improves the F1 score by up to 10.3% as compared to state-of-the-art methods.

Medical imaging deep learning models are often large and complex, requiring specialized hardware to train and evaluate these models. To address such issues, we propose the PocketNet paradigm to reduce the size of deep learning models by throttling the growth of the number of channels in convolutional neural networks. We demonstrate that, for a range of segmentation and classification tasks, PocketNet architectures produce results comparable to that of conventional neural networks while reducing the number of parameters by multiple orders of magnitude, using up to 90% less GPU memory, and speeding up training times by up to 40%, thereby allowing such models to be trained and deployed in resource-constrained settings.

Off-policy Evaluation (OPE) methods are crucial tools for evaluating policies in high-stakes domains such as healthcare, where direct deployment is often infeasible, unethical, or expensive. When deployment environments are expected to undergo changes (that is, dataset shifts), it is important for OPE methods to perform robust evaluation of the policies amidst such changes. Existing approaches consider robustness against a large class of shifts that can arbitrarily change any observable property of the environment. This often results in highly pessimistic estimates of the utilities, thereby invalidating policies that might have been useful in deployment. In this work, we address the aforementioned problem by investigating how domain knowledge can help provide more realistic estimates of the utilities of policies. We leverage human inputs on which aspects of the environments may plausibly change, and adapt the OPE methods to only consider shifts on these aspects. Specifically, we propose a novel framework, Robust OPE (ROPE), which considers shifts on a subset of covariates in the data based on user inputs, and estimates worst-case utility under these shifts. We then develop computationally efficient algorithms for OPE that are robust to the aforementioned shifts for contextual bandits and Markov decision processes. We also theoretically analyze the sample complexity of these algorithms. Extensive experimentation with synthetic and real world datasets from the healthcare domain demonstrates that our approach not only captures realistic dataset shifts accurately, but also results in less pessimistic policy evaluations.

Recent studies have shown that autoencoder-based models can achieve superior performance on anomaly detection tasks due to their excellent ability to fit complex data in an unsupervised manner. In this work, we propose a novel autoencoder-based model, named StackVAE-G that can significantly bring the efficiency and interpretability to multivariate time series anomaly detection. Specifically, we utilize the similarities across the time series channels by the stacking block-wise reconstruction with a weight-sharing scheme to reduce the size of learned models and also relieve the overfitting to unknown noises in the training data. We also leverage a graph learning module to learn a sparse adjacency matrix to explicitly capture the stable interrelation structure among multiple time series channels for the interpretable pattern reconstruction of interrelated channels. Combining these two modules, we introduce the stacking block-wise VAE (variational autoencoder) with GNN (graph neural network) model for multivariate time series anomaly detection. We conduct extensive experiments on three commonly used public datasets, showing that our model achieves comparable (even better) performance with the state-of-the-art modelsand meanwhile requires much less computation and memory cost. Furthermore, we demonstrate that the adjacency matrix learned by our model accurately captures the interrelation among multiple channels, and can provide valuable information for failure diagnosis applications.

Coordination graph is a promising approach to model agent collaboration in multi-agent reinforcement learning. It conducts a graph-based value factorization and induces explicit coordination among agents to complete complicated tasks. However, one critical challenge in this paradigm is the complexity of greedy action selection with respect to the factorized values. It refers to the decentralized constraint optimization problem (DCOP), which and whose constant-ratio approximation are NP-hard problems. To bypass this systematic hardness, this paper proposes a novel method, named Self-Organized Polynomial-time Coordination Graphs (SOP-CG), which uses structured graph classes to guarantee the accuracy and the computational efficiency of collaborated action selection. SOP-CG employs dynamic graph topology to ensure sufficient value function expressiveness. The graph selection is unified into an end-to-end learning paradigm. In experiments, we show that our approach learns succinct and well-adapted graph topologies, induces effective coordination, and improves performance across a variety of cooperative multi-agent tasks.

Machine Learning Techniques, properly combined with Data Structures, have resulted in Learned Static Indexes, innovative and powerful tools that speed-up Binary Search, with the use of additional space with respect to the table being searched into. Such space is devoted to the Machine Learning Model. Although in their infancy, they are methodologically and practically important, due to the pervasiveness of Sorted Table Search procedures. In modern applications, model space is a key factor and, in fact, a major open question concerning this area is to assess to what extent one can enjoy the speed-up of Binary Search achieved by Learned Indexes while using constant or nearly constant space models. In this paper, we investigate the mentioned question by (a) introducing two new models, i.e., the Learned k-ary Search Model and the Synoptic Recursive Model Index, respectively; (b) systematically exploring the time-space trade-offs of a hierarchy of existing models, i.e., the ones in the reference software platform Searching on Sorted Data, together with the new ones proposed here. By adhering and extending the current benchmarking methodology, we experimentally show that the Learned k-ary Search Model can speed up Binary Search in constant additional space. Our second model, together with the bi-criteria Piece-wise Geometric Model index, can achieve a speed-up of Binary Search with a model space of 0:05% more than the one taken by the table, being competitive in terms of time-space trade-off with existing proposals. The Synoptic Recursive Model Index and the bi-criteria Piece-wise Geometric Model complement each other quite well across the various levels of the internal memory hierarchy. Finally, our findings stimulate research in this area, since they highlight the need for further studies regarding the time-space relation in Learned Indexes.

Neural Networks are prone to having lesser accuracy in the classification of images with noise perturbation. Convolutional Neural Networks, CNNs are known for their unparalleled accuracy in the classification of benign images. But our study shows that they are extremely vulnerable to noise addition while Feed-forward Neural Networks, FNNs show very less correspondence with noise perturbation, maintaining their accuracy almost undisturbed. FNNs are observed to be better at classifying noise-intensive, single-channeled images that are just sheer noise to human vision. In our study, we have used the hand-written digits dataset, MNIST with the following architectures: FNNs with 1 and 2 hidden layers and CNNs with 3, 4, 6 and 8 convolutions and analyzed their accuracies. FNNs stand out to show that irrespective of the intensity of noise, they have a classification accuracy of more than 85%. In our analysis of CNNs with this data, the deceleration of classification accuracy of CNN with 8 convolutions was half of that of the rest of the CNNs. Correlation analysis and mathematical modelling of the accuracy trends act as roadmaps to these conclusions.

Node clustering is a powerful tool in the analysis of networks. We introduce a graph neural network framework to obtain node embeddings for directed networks in a self-supervised manner, including a novel probabilistic imbalance loss, which can be used for network clustering. Here, we propose directed flow imbalance measures, which are tightly related to directionality, to reveal clusters in the network even when there is no density difference between clusters. In contrast to standard approaches in the literature, in this paper, directionality is not treated as a nuisance, but rather contains the main signal. DIGRAC optimizes directed flow imbalance for clustering without requiring label supervision, unlike existing graph neural network methods, and can naturally incorporate node features, unlike existing spectral methods. Extensive experimental results on synthetic data, in the form of directed stochastic block models, and real-world data at different scales, demonstrate that our method, based on flow imbalance, attains state-of-the-art results on directed graph clustering when compared against 10 state-of-the-art methods from the literature, for a wide range of noise and sparsity levels, graph structures and topologies, and even outperforms supervised methods.

Characterizing the sensing and communication performance tradeoff in integrated sensing and communication (ISAC) systems is challenging in the applications of learning-based human motion recognition. This is because of the large experimental datasets and the black-box nature of deep neural networks. This paper presents SDP3, a Simulation-Driven Performance Predictor and oPtimizer, which consists of SDP3 data simulator, SDP3 performance predictor and SDP3 performance optimizer. Specifically, the SDP3 data simulator generates vivid wireless sensing datasets in a virtual environment, the SDP3 performance predictor predicts the sensing performance based on the function regression method, and the SDP3 performance optimizer investigates the sensing and communication performance tradeoff analytically. It is shown that the simulated sensing dataset matches the experimental dataset very well in the motion recognition accuracy. By leveraging SDP3, it is found that the achievable region of recognition accuracy and communication throughput consists of a communication saturation zone, a sensing saturation zone, and a communication-sensing adversarial zone, of which the desired balanced performance for ISAC systems lies in the third one.

Cryo-Electron Microscopy (cryo-EM) has emerged as a key technology to determine the structure of proteins, particularly large protein complexes and assemblies in recent years. A key challenge in cryo-EM data analysis is to automatically reconstruct accurate protein structures from cryo-EM density maps. In this review, we briefly overview various deep learning methods for building protein structures from cryo-EM density maps, analyze their impact, and discuss the challenges of preparing high-quality data sets for training deep learning models. Looking into the future, more advanced deep learning models of effectively integrating cryo-EM data with other sources of complementary data such as protein sequences and AlphaFold-predicted structures need to be developed to further advance the field.

Best subset of groups selection (BSGS) is the process of selecting a small part of non-overlapping groups to achieve the best interpretability on the response variable. It has attracted increasing attention and has far-reaching applications in practice. However, due to the computational intractability of BSGS in high-dimensional settings, developing efficient algorithms for solving BSGS remains a research hotspot. In this paper,we propose a group-splicing algorithm that iteratively detects the relevant groups and excludes the irrelevant ones. Moreover, coupled with a novel group information criterion, we develop an adaptive algorithm to determine the optimal model size. Under mild conditions, it is certifiable that our algorithm can identify the optimal subset of groups in polynomial time with high probability. Finally, we demonstrate the efficiency and accuracy of our methods by comparing them with several state-of-the-art algorithms on both synthetic and real-world datasets.

The thin-file borrowers are customers for whom a creditworthiness assessment is uncertain due to their lack of credit history; many researchers have used borrowers' relationships and interactions networks in the form of graphs as an alternative data source to address this. Incorporating network data is traditionally made by hand-crafted feature engineering, and lately, the graph neural network has emerged as an alternative, but it still does not improve over the traditional method's performance. Here we introduce a framework to improve credit scoring models by blending several Graph Representation Learning methods: feature engineering, graph embeddings, and graph neural networks. We stacked their outputs to produce a single score in this approach. We validated this framework using a unique multi-source dataset that characterizes the relationships and credit history for the entire population of a Latin American country, applying it to credit risk models, application, and behavior, targeting both individuals and companies. Our results show that the graph representation learning methods should be used as complements, and these should not be seen as self-sufficient methods as is currently done. In terms of AUC and KS, we enhance the statistical performance, outperforming traditional methods. In Corporate lending, where the gain is much higher, it confirms that evaluating an unbanked company cannot solely consider its features. The business ecosystem where these firms interact with their owners, suppliers, customers, and other companies provides novel knowledge that enables financial institutions to enhance their creditworthiness assessment. Our results let us know when and which group to use graph data and what effects on performance to expect. They also show the enormous value of graph data on the unbanked credit scoring problem, principally to help companies' banking.

\cite{rohe2016co} proposed Stochastic co-Blockmodel (ScBM) as a tool for detecting community structure of binary directed graph data in network studies. However, ScBM completely ignores node weight, and is unable to explain the block structure of directed weighted network which appears in various areas, such as biology, sociology, physiology and computer science. Here, to model directed weighted network, we introduce a Directed Distribution-Free model by releasing ScBM's distribution restriction. We also build an extension of the proposed model by considering variation of node degree. Our models do not require a specific distribution on generating elements of adjacency matrix but only a block structure on the expected adjacency matrix. Spectral algorithms with theoretical guarantee on consistent estimation of node label are presented to identify communities. Our proposed methods are illustrated by simulated and empirical examples.

In contrast to single-objective optimization (SOO), multi-objective optimization (MOO) requires an optimizer to find the Pareto frontier, a subset of feasible solutions that are not dominated by other feasible solutions. In this paper, we propose LaMOO, a novel multi-objective optimizer that learns a model from observed samples to partition the search space and then focus on promising regions that are likely to contain a subset of the Pareto frontier. The partitioning is based on the dominance number, which measures "how close" a data point is to the Pareto frontier among existing samples. To account for possible partition errors due to limited samples and model mismatch, we leverage Monte Carlo Tree Search (MCTS) to exploit promising regions while exploring suboptimal regions that may turn out to contain good solutions later. Theoretically, we prove the efficacy of learning space partitioning via LaMOO under certain assumptions. Empirically, on the HyperVolume (HV) benchmark, a popular MOO metric, LaMOO substantially outperforms strong baselines on multiple real-world MOO tasks, by up to 225% in sample efficiency for neural architecture search on Nasbench201, and up to 10% for molecular design.

Hypercomplex neural networks have proven to reduce the overall number of parameters while ensuring valuable performance by leveraging the properties of Clifford algebras. Recently, hypercomplex linear layers have been further improved by involving efficient parameterized Kronecker products. In this paper, we define the parameterization of hypercomplex convolutional layers and introduce the family of parameterized hypercomplex neural networks (PHNNs) that are lightweight and efficient large-scale models. Our method grasps the convolution rules and the filter organization directly from data without requiring a rigidly predefined domain structure to follow. PHNNs are flexible to operate in any user-defined or tuned domain, from 1D to $n$D regardless of whether the algebra rules are preset. Such a malleability allows processing multidimensional inputs in their natural domain without annexing further dimensions, as done, instead, in quaternion neural networks for 3D inputs like color images. As a result, the proposed family of PHNNs operates with $1/n$ free parameters as regards its analog in the real domain. We demonstrate the versatility of this approach to multiple domains of application by performing experiments on various image datasets as well as audio datasets in which our method outperforms real and quaternion-valued counterparts. Full code is available at: https://github.com/eleGAN23/HyperNets.

The CP decomposition for high dimensional non-orthogonal spiked tensors is an important problem with broad applications across many disciplines. However, previous works with theoretical guarantee typically assume restrictive incoherence conditions on the basis vectors for the CP components. In this paper, we propose new computationally efficient composite PCA and concurrent orthogonalization algorithms for tensor CP decomposition with theoretical guarantees under mild incoherence conditions. The composite PCA applies the principal component or singular value decompositions twice, first to a matrix unfolding of the tensor data to obtain singular vectors and then to the matrix folding of the singular vectors obtained in the first step. It can be used as an initialization for any iterative optimization schemes for the tensor CP decomposition. The concurrent orthogonalization algorithm iteratively estimates the basis vector in each mode of the tensor by simultaneously applying projections to the orthogonal complements of the spaces generated by other CP components in other modes. It is designed to improve the alternating least squares estimator and other forms of the high order orthogonal iteration for tensors with low or moderately high CP ranks, and it is guaranteed to converge rapidly when the error of any given initial estimator is bounded by a small constant. Our theoretical investigation provides estimation accuracy and convergence rates for the two proposed algorithms. Both proposed algorithms are applicable to deterministic tensor, its noisy version, and the order-$2K$ covariance tensor of order-$K$ tensor data in a factor model with uncorrelated factors. Our implementations on synthetic data demonstrate significant practical superiority of our approach over existing methods.

An effective weighting scheme for training samples is essential for learning tasks. Numerous weighting schemes have been proposed. Some schemes take the easy-first mode, whereas some others take the hard-first one. Naturally, an interesting yet realistic question is raised. Which samples should be learned first given a new learning task, easy or hard? To answer this question, both theoretical analyses and experimental verification are conducted. First, a general optimized objective function is proposed, revealing the relationship between the difficulty distribution and the difficulty-based sample weights. Second, on the basis of the optimized objective function, theoretical answers are obtained. Besides the easy-first and hard-first modes, there are two other priority modes, namely, medium-first and two-ends-first. The prior mode does not necessarily remain unchanged during the training process. Third, an effective and universal solution is proposed to select the optimal priority mode when there is no prior knowledge or theoretical clues. The four modes, namely, easy/medium/hard/two-ends-first, can be flexibly switched in the proposed solution. Fourth, a wide range of experiments is conducted under various scenarios to further compare the weighting schemes in different modes. On the basis of these works, reasonable and comprehensive answers are obtained. Factors including the distribution of samples' learning difficulties and the validation data determine which samples should be learned first in a learning task.

The success of neural networks over the past decade has established them as effective models for many relevant data generating processes. Statistical theory on neural networks indicates graceful scaling of sample complexity. For example, Joen & Van Roy (arXiv:2203.00246) demonstrate that, when data is generated by a ReLU teacher network with $W$ parameters, an optimal learner needs only $\tilde{O}(W/\epsilon)$ samples to attain expected error $\epsilon$. However, existing computational theory suggests that, even for single-hidden-layer teacher networks, to attain small error for all such teacher networks, the computation required to achieve this sample complexity is intractable. In this work, we fit single-hidden-layer neural networks to data generated by single-hidden-layer ReLU teacher networks with parameters drawn from a natural distribution. We demonstrate that stochastic gradient descent (SGD) with automated width selection attains small expected error with a number of samples and total number of queries both nearly linear in the input dimension and width. This suggests that SGD nearly achieves the information-theoretic sample complexity bounds of Joen & Van Roy (arXiv:2203.00246) in a computationally efficient manner. An important difference between our positive empirical results and the negative theoretical results is that the latter address worst-case error of deterministic algorithms, while our analysis centers on expected error of a stochastic algorithm.

Since their introduction, graph attention networks achieved outstanding results in graph representation learning tasks. However, these networks consider only pairwise relationships among nodes and then they are not able to fully exploit higher-order interactions present in many real world data-sets. In this paper, we introduce Cell Attention Networks (CANs), a neural architecture operating on data defined over the vertices of a graph, representing the graph as the 1-skeleton of a cell complex introduced to capture higher order interactions. In particular, we exploit the lower and upper neighborhoods, as encoded in the cell complex, to design two independent masked self-attention mechanisms, thus generalizing the conventional graph attention strategy. The approach used in CANs is hierarchical and it incorporates the following steps: i) a lifting algorithm that learns {\it edge features} from {\it node features}; ii) a cell attention mechanism to find the optimal combination of edge features over both lower and upper neighbors; iii) a hierarchical {\it edge pooling} mechanism to extract a compact meaningful set of features. The experimental results show that CAN is a low complexity strategy that compares favorably with state of the art results on graph-based learning tasks.

Homomorphic sensing is a recent algebraic-geometric framework that studies the unique recovery of points in a linear subspace from their images under a given collection of linear maps. It has been successful in interpreting such a recovery in the case of permutations composed by coordinate projections, an important instance in applications known as unlabeled sensing, which models data that are out of order and have missing values. In this paper, we provide tighter and simpler conditions that guarantee the unique recovery for the single-subspace case, extend the result to the case of a subspace arrangement, and show that the unique recovery in a single subspace is locally stable under noise. We specialize our results to several examples of homomorphic sensing such as real phase retrieval and unlabeled sensing. In so doing, in a unified way, we obtain conditions that guarantee the unique recovery for those examples, typically known via diverse techniques in the literature, as well as novel conditions for sparse and unsigned versions of unlabeled sensing. Similarly, our noise result also implies that the unique recovery in unlabeled sensing is locally stable.

In real scenarios, state observations that an agent observes may contain measurement errors or adversarial noises, misleading the agent to take suboptimal actions or even collapse while training. In this paper, we study the training robustness of distributional Reinforcement Learning~(RL), a class of state-of-the-art methods that estimate the whole distribution, as opposed to only the expectation, of the total return. Firstly, we validate the contraction of distributional Bellman operators in the State-Noisy Markov Decision Process~(SN-MDP), a typical tabular case that incorporates both random and adversarial state observation noises. In the noisy setting with function approximation, we then analyze the vulnerability of least squared loss in expectation-based RL with either linear or nonlinear function approximation. By contrast, we theoretically characterize the bounded gradient norm of distributional RL loss based on the categorical parameterization equipped with the Kullback-Leibler~(KL) divergence. The resulting stable gradients while the optimization in distributional RL accounts for its better training robustness against state observation noises. Finally, extensive experiments on the suite of environments verified that distributional RL is less vulnerable against both random and adversarial noisy state observations compared with its expectation-based counterpart.

We study the offline reinforcement learning (RL) in the face of unmeasured confounders. Due to the lack of online interaction with the environment, offline RL is facing the following two significant challenges: (i) the agent may be confounded by the unobserved state variables; (ii) the offline data collected a prior does not provide sufficient coverage for the environment. To tackle the above challenges, we study the policy learning in the confounded MDPs with the aid of instrumental variables. Specifically, we first establish value function (VF)-based and marginalized importance sampling (MIS)-based identification results for the expected total reward in the confounded MDPs. Then by leveraging pessimism and our identification results, we propose various policy learning methods with the finite-sample suboptimality guarantee of finding the optimal in-class policy under minimal data coverage and modeling assumptions. Lastly, our extensive theoretical investigations and one numerical study motivated by the kidney transplantation demonstrate the promising performance of the proposed methods.

Recent advances in unsupervised representation learning significantly improved the sample efficiency of training Reinforcement Learning policies in simulated environments. However, similar gains have not yet been seen for real-robot reinforcement learning. In this work, we focus on enabling data-efficient real-robot learning from pixels. We present Contrastive Pre-training and Data Augmentation for Efficient Robotic Learning (CoDER), a method that utilizes data augmentation and unsupervised learning to achieve sample-efficient training of real-robot arm policies from sparse rewards. While contrastive pre-training, data augmentation, demonstrations, and reinforcement learning are alone insufficient for efficient learning, our main contribution is showing that the combination of these disparate techniques results in a simple yet data-efficient method. We show that, given only 10 demonstrations, a single robotic arm can learn sparse-reward manipulation policies from pixels, such as reaching, picking, moving, pulling a large object, flipping a switch, and opening a drawer in just 30 minutes of mean real-world training time. We include videos and code on the project website: https://sites.google.com/view/efficient-robotic-manipulation/home

Principal Component Analysis (PCA) minimizes the reconstruction error given a class of linear models of fixed component dimensionality. Probabilistic PCA adds a probabilistic structure by learning the probability distribution of the PCA latent space weights, thus creating a generative model. Autoencoders (AE) minimize the reconstruction error in a class of nonlinear models of fixed latent space dimensionality and outperform PCA at fixed dimensionality. Here, we introduce the Probabilistic Autoencoder (PAE) that learns the probability distribution of the AE latent space weights using a normalizing flow (NF). The PAE is fast and easy to train and achieves small reconstruction errors, high sample quality, and good performance in downstream tasks. We compare the PAE to Variational AE (VAE), showing that the PAE trains faster, reaches a lower reconstruction error, and produces good sample quality without requiring special tuning parameters or training procedures. We further demonstrate that the PAE is a powerful model for performing the downstream tasks of probabilistic image reconstruction in the context of Bayesian inference of inverse problems for inpainting and denoising applications. Finally, we identify latent space density from NF as a promising outlier detection metric.

We present a novel collection of news articles originating from fake and real news media sources for the analysis and prediction of news virality. Unlike existing fake news datasets which either contain claims or news article headline and body, in this collection each article is supported with a Facebook engagement count which we consider as an indicator of the article virality. In addition we also provide the article description and thumbnail image with which the article was shared on Facebook. These images were automatically annotated with object tags and color attributes. Using cloud based vision analysis tools, thumbnail images were also analyzed for faces and detected faces were annotated with facial attributes. We empirically investigate the use of this collection on an example task of article virality prediction.

Audio segmentation and sound event detection are crucial topics in machine listening that aim to detect acoustic classes and their respective boundaries. It is useful for audio-content analysis, speech recognition, audio-indexing, and music information retrieval. In recent years, most research articles adopt segmentation-by-classification. This technique divides audio into small frames and individually performs classification on these frames. In this paper, we present a novel approach called You Only Hear Once (YOHO), which is inspired by the YOLO algorithm popularly adopted in Computer Vision. We convert the detection of acoustic boundaries into a regression problem instead of frame-based classification. This is done by having separate output neurons to detect the presence of an audio class and predict its start and end points. The relative improvement for F-measure of YOHO, compared to the state-of-the-art Convolutional Recurrent Neural Network, ranged from 1% to 6% across multiple datasets for audio segmentation and sound event detection. As the output of YOHO is more end-to-end and has fewer neurons to predict, the speed of inference is at least 6 times faster than segmentation-by-classification. In addition, as this approach predicts acoustic boundaries directly, the post-processing and smoothing is about 7 times faster.

Gas network planning optimization under emission constraints prioritizes gas supply with the least CO$_2$ intensity. As this problem includes complex physical laws of gas flow, standard optimization solvers cannot guarantee convergence to a feasible solution. To address this issue, we develop an input-convex neural network (ICNN) aided optimization routine which incorporates a set of trained ICNNs approximating the gas flow equations with high precision. Numerical tests on the Belgium gas network demonstrate that the ICNN-aided optimization dominates non-convex and relaxation-based solvers, with larger optimality gains pertaining to stricter emission targets. Moreover, whenever the non-convex solver fails, the ICNN-aided optimization provides a feasible solution to network planning.

Processing-in-memory (PIM), an increasingly studied neuromorphic hardware, promises orders of energy and throughput improvements for deep learning inference. Leveraging the massively parallel and efficient analog computing inside memories, PIM circumvents the bottlenecks of data movements in conventional digital hardware. However, an extra quantization step (i.e. PIM quantization), typically with limited resolution due to hardware constraints, is required to convert the analog computing results into digital domain. Meanwhile, non-ideal effects extensively exist in PIM quantization because of the imperfect analog-to-digital interface, which further compromises the inference accuracy. In this paper, we propose a method for training quantized networks to incorporate PIM quantization, which is ubiquitous to all PIM systems. Specifically, we propose a PIM quantization aware training (PIM-QAT) algorithm, and introduce rescaling techniques during backward and forward propagation by analyzing the training dynamics to facilitate training convergence. We also propose two techniques, namely batch normalization (BN) calibration and adjusted precision training, to suppress the adverse effects of non-ideal linearity and stochastic thermal noise involved in real PIM chips. Our method is validated on three mainstream PIM decomposition schemes, and physically on a prototype chip. Comparing with directly deploying conventionally trained quantized model on PIM systems, which does not take into account this extra quantization step and thus fails, our method provides significant improvement. It also achieves comparable inference accuracy on PIM systems as that of conventionally quantized models on digital hardware, across CIFAR10 and CIFAR100 datasets using various network depths for the most popular network topology.

Decentralized learning has shown great promise for cooperative multi-agent reinforcement learning (MARL). However, non-stationarity remains a significant challenge in decentralized learning. In the paper, we tackle the non-stationarity problem in the simplest and fundamental way and propose \textit{multi-agent alternate Q-learning} (MA2QL), where agents take turns to update their Q-functions by Q-learning. MA2QL is a \textit{minimalist} approach to fully decentralized cooperative MARL but is theoretically grounded. We prove that when each agent guarantees a $\varepsilon$-convergence at each turn, their joint policy converges to a Nash equilibrium. In practice, MA2QL only requires minimal changes to independent Q-learning (IQL). We empirically evaluate MA2QL on a variety of cooperative multi-agent tasks. Results show MA2QL consistently outperforms IQL, which verifies the effectiveness of MA2QL, despite such minimal changes.

Personalized federated learning allows for clients in a distributed system to train a neural network tailored to their unique local data while leveraging information at other clients. However, clients' models are vulnerable to attacks during both the training and testing phases. In this paper we address the issue of adversarial clients crafting evasion attacks at test time to deceive other clients. For example, adversaries may aim to deceive spam filters and recommendation systems trained with personalized federated learning for monetary gain. The adversarial clients have varying degrees of personalization based on the method of distributed learning, leading to a "grey-box" situation. We are the first to characterize the transferability of such internal evasion attacks for different learning methods and analyze the trade-off between model accuracy and robustness depending on the degree of personalization and similarities in client data. We introduce a defense mechanism, pFedDef, that performs personalized federated adversarial training while respecting resource limitations at clients that inhibit adversarial training. Overall, pFedDef increases relative grey-box adversarial robustness by 62% compared to federated adversarial training and performs well even under limited system resources.

We propose a simple modification to standard ResNet architectures--L2 regularization over feature space--that substantially improves out-of-distribution (OoD) performance on the previously proposed Deep Deterministic Uncertainty (DDU) benchmark. This change also induces early Neural Collapse (NC), which we show is an effect under which better OoD performance is more probable. Our method achieves comparable or superior OoD detection scores and classification accuracy in a small fraction of the training time of the benchmark. Additionally, it substantially improves worst case OoD performance over multiple, randomly initialized models. Though we do not suggest that NC is the sole mechanism or comprehensive explanation for OoD behaviour in deep neural networks (DNN), we believe NC's simple mathematical and geometric structure can provide an framework for analysis of this complex phenomenon in future work.

Hybrid modeling combining data-driven techniques and numerical methods is an emerging and promising research direction for efficient climate simulation. However, previous works lack practical platforms, making developing hybrid modeling a challenging programming problem. Furthermore, the lack of standard data sets and evaluation metrics may hamper researchers from comprehensively comparing various algorithms under a uniform condition. To address these problems, we propose a framework called NeuroClim for hybrid modeling under the real-world scenario, a basic setting to simulate the real climate that we live in. NeuroClim consists of three parts: (1) Platform. We develop a user-friendly platform NeuroGCM for efficiently developing hybrid modeling in climate simulation. (2) Dataset. We provide an open-source dataset for data-driven methods in hybrid modeling. We investigate the characteristics of the data, i.e., heterogeneity and stiffness, which reveals the difficulty of regressing climate simulation data; (3) Metrics. We propose a methodology for quantitatively evaluating hybrid modeling, including the approximation ability of machine learning models and the stability during simulation. We believe that NeuroClim allows researchers to work without high level of climate-related expertise and focus only on machine learning algorithm design, which will accelerate hybrid modeling research in the AI-Climate intersection. The codes and data are released at https://github.com/x-w19/NeuroClim.

This paper provides fascinating connections between several mathematical problems which lie on the intersection of several mathematics subjects, namely algebraic geometry, approximation theory, complex-harmonic analysis and high dimensional data science. Modern techniques in algebraic geometry, approximation theory, computational harmonic analysis and extensions develop the first of its kind, a unified framework which allows for a simultaneous study of labeled and unlabeled near alignment data problems in of $\mathbb R^D$ with the near isometry extension problem for discrete and non-discrete subsets of $\mathbb R^D$ with certain geometries. In addition, the paper surveys related work on clustering, dimension reduction, manifold learning, vision as well as minimal energy partitions, discrepancy and min-max optimization. Numerous open problems are given.

Two aspects of neural networks that have been extensively studied in the recent literature are their function approximation properties and their training by gradient descent methods. The approximation problem seeks accurate approximations with a minimal number of weights. In most of the current literature these weights are fully or partially hand-crafted, showing the capabilities of neural networks but not necessarily their practical performance. In contrast, optimization theory for neural networks heavily relies on an abundance of weights in over-parametrized regimes. This paper balances these two demands and provides an approximation result for shallow networks in $1d$ with non-convex weight optimization by gradient descent. We consider finite width networks and infinite sample limits, which is the typical setup in approximation theory. Technically, this problem is not over-parametrized, however, some form of redundancy reappears as a loss in approximation rate compared to best possible rates.

There has been much recent research on human activity re\-cog\-ni\-tion (HAR), due to the proliferation of wearable sensors in watches and phones, and the advances of deep learning methods, which avoid the need to manually extract features from raw sensor signals. A significant disadvantage of deep learning applied to HAR is the need for manually labelled training data, which is especially difficult to obtain for HAR datasets. Progress is starting to be made in the unsupervised setting, in the form of deep HAR clustering models, which can assign labels to data without having been given any labels to train on, but there are problems with evaluating deep HAR clustering models, which makes assessing the field and devising new methods difficult. In this paper, we highlight several distinct problems with how deep HAR clustering models are evaluated, describing these problems in detail and conducting careful experiments to explicate the effect that they can have on results. We then discuss solutions to these problems, and suggest standard evaluation settings for future deep HAR clustering models. Additionally, we present a new deep clustering model for HAR. When tested under our proposed settings, our model performs better than (or on par with) existing models, while also being more efficient and better able to scale to more complex datasets by avoiding the need for an autoencoder.

The problem of inferring the direct causal parents of a response variable among a large set of explanatory variables is of high practical importance in many disciplines. However, established approaches often scale at least exponentially with the number of explanatory variables, are difficult to extend to nonlinear relationships, and are difficult to extend to cyclic data. Inspired by {\em Debiased} machine learning methods, we study a one-vs.-the-rest feature selection approach to discover the direct causal parent of the response. We propose an algorithm that works for purely observational data while also offering theoretical guarantees, including the case of partially nonlinear relationships possibly under the presence of cycles. As it requires only one estimation for each variable, our approach is applicable even to large graphs. We demonstrate significant improvements compared to established approaches.

In this work, we present our journey to revolutionize the personalized recommendation engine through end-to-end learning from raw user actions. We encode user's long-term interest in Pinner- Former, a user embedding optimized for long-term future actions via a new dense all-action loss, and capture user's short-term intention by directly learning from the real-time action sequences. We conducted both offline and online experiments to validate the performance of the new model architecture, and also address the challenge of serving such a complex model using mixed CPU/GPU setup in production. The proposed system has been deployed in production at Pinterest and has delivered significant online gains across organic and Ads applications.

Deep learning models have shown impressive results in a variety of time series forecasting tasks, where modeling the conditional distribution of the future given the past is the essence. However, when this conditional distribution is non-stationary, it poses challenges for these models to learn consistently and to predict accurately. In this work, we propose a new method to model non-stationary conditional distributions over time by clearly decoupling stationary conditional distribution modeling from non-stationary dynamics modeling. Our method is based on a Bayesian dynamic model that can adapt to conditional distribution changes and a deep conditional distribution model that can handle large multivariate time series using a factorized output space. Our experimental results on synthetic and popular public datasets show that our model can adapt to non-stationary time series better than state-of-the-art deep learning solutions.

While reinforcement learning (RL) methods that learn an internal model of the environment have the potential to be more sample efficient than their model-free counterparts, learning to model raw observations from high dimensional sensors can be challenging. Prior work has addressed this challenge by learning low-dimensional representation of observations through auxiliary objectives, such as reconstruction or value prediction. However, the alignment between these auxiliary objectives and the RL objective is often unclear. In this work, we propose a single objective which jointly optimizes a latent-space model and policy to achieve high returns while remaining self-consistent. This objective is a lower bound on expected returns. Unlike prior bounds for model-based RL on policy exploration or model guarantees, our bound is directly on the overall RL objective. We demonstrate that the resulting algorithm matches or improves the sample-efficiency of the best prior model-based and model-free RL methods. While such sample efficient methods typically are computationally demanding, our method attains the performance of SAC in about 50\% less wall-clock time.

Electric vehicles (EVs) play critical roles in autonomous mobility-on-demand (AMoD) systems, but their unique charging patterns increase the model uncertainties in AMoD systems (e.g. state transition probability). Since there usually exists a mismatch between the training and test (true) environments, incorporating model uncertainty into system design is of critical importance in real-world applications. However, model uncertainties have not been considered explicitly in EV AMoD system rebalancing by existing literature yet and remain an urgent and challenging task. In this work, we design a robust and constrained multi-agent reinforcement learning (MARL) framework with transition kernel uncertainty for the EV rebalancing and charging problem. We then propose a robust and constrained MARL algorithm (ROCOMA) that trains a robust EV rebalancing policy to balance the supply-demand ratio and the charging utilization rate across the whole city under state transition uncertainty. Experiments show that the ROCOMA can learn an effective and robust rebalancing policy. It outperforms non-robust MARL methods when there are model uncertainties. It increases the system fairness by 19.6% and decreases the rebalancing costs by 75.8%.

Human texture perception is a weighted average of multi-sensory inputs: visual and tactile. While the visual sensing mechanism extracts global features, the tactile mechanism complements it by extracting local features. The lack of coupled visuotactile datasets in the literature is a challenge for studying multimodal fusion strategies analogous to human texture perception. This paper presents a visual dataset that augments an existing tactile dataset. We propose a novel deep fusion architecture that fuses visual and tactile data using four types of fusion strategies: summation, concatenation, max-pooling, and attention. Our model shows significant performance improvements (97.22%) in surface roughness classification accuracy over tactile only (SVM - 92.60%) and visual only (FENet-50 - 85.01%) architectures. Among the several fusion techniques, attention-guided architecture results in better classification accuracy. Our study shows that analogous to human texture perception, the proposed model chooses a weighted combination of the two modalities (visual and tactile), thus resulting in higher surface roughness classification accuracy; and it chooses to maximize the weightage of the tactile modality where the visual modality fails and vice-versa.

Using information-theoretic principles, we consider the generalization error (gen-error) of iterative semi-supervised learning (SSL) algorithms that iteratively generate pseudo-labels for a large amount of unlabelled data to progressively refine the model parameters. In contrast to most previous works that {\em bound} the gen-error, we provide an {\em exact} expression for the gen-error and particularize it to the binary Gaussian mixture model. Our theoretical results suggest that when the class conditional variances are not too large, the gen-error decreases with the number of iterations, but quickly saturates. On the flip side, if the class conditional variances (and so amount of overlap between the classes) are large, the gen-error increases with the number of iterations. To mitigate this undesirable effect, we show that regularization can reduce the gen-error. The theoretical results are corroborated by extensive experiments on the MNIST and CIFAR datasets in which we notice that for easy-to-distinguish classes, the gen-error improves after several pseudo-labelling iterations, but saturates afterwards, and for more difficult-to-distinguish classes, regularization improves the generalization performance.

We consider the problem of learning the optimal threshold policy for control problems. Threshold policies make control decisions by evaluating whether an element of the system state exceeds a certain threshold, whose value is determined by other elements of the system state. By leveraging the monotone property of threshold policies, we prove that their policy gradients have a surprisingly simple expression. We use this simple expression to build an off-policy actor-critic algorithm for learning the optimal threshold policy. Simulation results show that our policy significantly outperforms other reinforcement learning algorithms due to its ability to exploit the monotone property. In addition, we show that the Whittle index, a powerful tool for restless multi-armed bandit problems, is equivalent to the optimal threshold policy for an alternative problem. This observation leads to a simple algorithm that finds the Whittle index by learning the optimal threshold policy in the alternative problem. Simulation results show that our algorithm learns the Whittle index much faster than several recent studies that learn the Whittle index through indirect means.

Flocking control is a significant problem in multi-agent systems such as multi-agent unmanned aerial vehicles and multi-agent autonomous underwater vehicles, which enhances the cooperativity and safety of agents. In contrast to traditional methods, multi-agent reinforcement learning (MARL) solves the problem of flocking control more flexibly. However, methods based on MARL suffer from sample inefficiency, since they require a huge number of experiences to be collected from interactions between agents and the environment. We propose a novel method Pretraining with Demonstrations for MARL (PwD-MARL), which can utilize non-expert demonstrations collected in advance with traditional methods to pretrain agents. During the process of pretraining, agents learn policies from demonstrations by MARL and behavior cloning simultaneously, and are prevented from overfitting demonstrations. By pretraining with non-expert demonstrations, PwD-MARL improves sample efficiency in the process of online MARL with a warm start. Experiments show that PwD-MARL improves sample efficiency and policy performance in the problem of flocking control, even with bad or few demonstrations.

Global Navigation Satellite Systems typically perform poorly in urban environments, where the likelihood of line-of-sight conditions between the devices and the satellites is low, and thus alternative localization methods are required for good accuracy. We present LocUNet: A convolutional, end-to-end trained neural network for the localization task, able to estimate the position of a user from the received signal strength (RSS) from a small number of Base Stations (BSs). In the proposed method, the user to be localized simply reports the measured RSS to a central processing unit, which may be located in the cloud. Using estimations of pathloss radio maps of the BSs and the RSS measurements, LocUNet can localize users with state-of-the-art accuracy and enjoys high robustness to inaccuracies in the estimations of radio maps. The proposed method does not require pre-sampling of new environments and is suitable for real-time applications. Moreover, two novel datasets that allow for numerical evaluations of RSS and ToA methods in realistic urban environments are presented and made publicly available for the research community. By using these datasets, we also provide a fair comparison of state-of-the-art RSS and ToA-based methods in the dense urban scenario and show numerically that LocUNet outperforms all the compared methods.

A large body of work shows that machine learning (ML) models can leak sensitive or confidential information about their training data. Recently, leakage due to distribution inference (or property inference) attacks is gaining attention. In this attack, the goal of an adversary is to infer distributional information about the training data. So far, research on distribution inference has focused on demonstrating successful attacks, with little attention given to identifying the potential causes of the leakage and to proposing mitigations. To bridge this gap, as our main contribution, we theoretically and empirically analyze the sources of information leakage that allows an adversary to perpetrate distribution inference attacks. We identify three sources of leakage: (1) memorizing specific information about the $\mathbb{E}[Y|X]$ (expected label given the feature values) of interest to the adversary, (2) wrong inductive bias of the model, and (3) finiteness of the training data. Next, based on our analysis, we propose principled mitigation techniques against distribution inference attacks. Specifically, we demonstrate that causal learning techniques are more resilient to a particular type of distribution inference risk termed distributional membership inference than associative learning methods. And lastly, we present a formalization of distribution inference that allows for reasoning about more general adversaries than was previously possible.

In this paper, we study the problem of learning a repertoire of low-level skills from raw images that can be sequenced to complete long-horizon visuomotor tasks. Reinforcement learning (RL) is a promising approach for acquiring short-horizon skills autonomously. However, the focus of RL algorithms has largely been on the success of those individual skills, more so than learning and grounding a large repertoire of skills that can be sequenced to complete extended multi-stage tasks. The latter demands robustness and persistence, as errors in skills can compound over time, and may require the robot to have a number of primitive skills in its repertoire, rather than just one. To this end, we introduce EMBER, a model-based RL method for learning primitive skills that are suitable for completing long-horizon visuomotor tasks. EMBER learns and plans using a learned model, critic, and success classifier, where the success classifier serves both as a reward function for RL and as a grounding mechanism to continuously detect if the robot should retry a skill when unsuccessful or under perturbations. Further, the learned model is task-agnostic and trained using data from all skills, enabling the robot to efficiently learn a number of distinct primitives. These visuomotor primitive skills and their associated pre- and post-conditions can then be directly combined with off-the-shelf symbolic planners to complete long-horizon tasks. On a Franka Emika robot arm, we find that EMBER enables the robot to complete three long-horizon visuomotor tasks at 85% success rate, such as organizing an office desk, a file cabinet, and drawers, which require sequencing up to 12 skills, involve 14 unique learned primitives, and demand generalization to novel objects.

Resting state fMRI is an imaging modality which reveals brain activity localization through signal changes, in what is known as Resting State Networks (RSNs). This technique is gaining popularity in neurosurgical pre-planning to visualize the functional regions and assess regional activity. Labeling of rs-fMRI networks require subject-matter expertise and is time consuming, creating a need for an automated classification algorithm. While the impact of AI in medical diagnosis has shown great progress; deploying and maintaining these in a clinical setting is an unmet need. We propose an end-to-end reproducible pipeline which incorporates image processing of rs-fMRI in a cloud-based workflow while using deep learning to automate the classification of RSNs. We have architected a reproducible Azure Machine Learning cloud-based medical imaging concept pipeline for fMRI analysis integrating the popular FMRIB Software Library (FSL) toolkit. To demonstrate a clinical application using a large dataset, we compare three neural network architectures for classification of deeper RSNs derived from processed rs-fMRI. The three algorithms are: an MLP, a 2D projection-based CNN, and a fully 3D CNN classification networks. Each of the net-works was trained on the rs-fMRI back-projected independent components giving >98% accuracy for each classification method.

We address the problem of uncertainty calibration and introduce a novel calibration method, Parametrized Temperature Scaling (PTS). Standard deep neural networks typically yield uncalibrated predictions, which can be transformed into calibrated confidence scores using post-hoc calibration methods. In this contribution, we demonstrate that the performance of accuracy-preserving state-of-the-art post-hoc calibrators is limited by their intrinsic expressive power. We generalize temperature scaling by computing prediction-specific temperatures, parameterized by a neural network. We show with extensive experiments that our novel accuracy-preserving approach consistently outperforms existing algorithms across a large number of model architectures, datasets and metrics.

Algorithmic decision-making in societal contexts, such as retail pricing, loan administration, recommendations on online platforms, etc., often involves experimentation with decisions for the sake of learning, which results in perceptions of unfairness among people impacted by these decisions. It is hence necessary to embed appropriate notions of fairness in such decision-making processes. The goal of this paper is to highlight the rich interface between temporal notions of fairness and online decision-making through a novel meta-objective of ensuring fairness at the time of decision. Given some arbitrary comparative fairness notion for static decision-making (e.g., students should pay at most 90% of the general adult price), a corresponding online decision-making algorithm satisfies fairness at the time of decision if the said notion of fairness is satisfied for any entity receiving a decision in comparison to all the past decisions. We show that this basic requirement introduces new methodological challenges in online decision-making. We illustrate the novel approaches necessary to address these challenges in the context of stochastic convex optimization with bandit feedback under a comparative fairness constraint that imposes lower bounds on the decisions received by entities depending on the decisions received by everyone in the past. The paper showcases novel research opportunities in online decision-making stemming from temporal fairness concerns.

Distributional reinforcement learning~(RL) is a class of state-of-the-art algorithms that estimate the whole distribution of the total return rather than only its expectation. Despite the remarkable performance of distributional RL, a theoretical understanding of its advantages over expectation-based RL remains elusive. In this paper, we attribute the superiority of distributional RL to its regularization effect in terms of the value distribution information regardless of its expectation. Firstly, by leverage of a variant of the gross error model in robust statistics, we decompose the value distribution into its expectation and the remaining distribution part. As such, the extra benefit of distributional RL compared with expectation-based RL is mainly interpreted as the impact of a \textit{risk-sensitive entropy regularization} within the Neural Fitted Z-Iteration framework. Meanwhile, we establish a bridge between the risk-sensitive entropy regularization of distributional RL and the vanilla entropy in maximum entropy RL, focusing specifically on actor-critic algorithms. It reveals that distributional RL induces a corrected reward function and thus promotes a risk-sensitive exploration against the intrinsic uncertainty of the environment. Finally, extensive experiments corroborate the role of the regularization effect of distributional RL and uncover mutual impacts of different entropy regularization. Our research paves a way towards better interpreting the efficacy of distributional RL algorithms, especially through the lens of regularization.

We propose a new approach, Knowledge Distillation using Optimal Transport (KNOT), to distill the natural language semantic knowledge from multiple teacher networks to a student network. KNOT aims to train a (global) student model by learning to minimize the optimal transport cost of its assigned probability distribution over the labels to the weighted sum of probabilities predicted by the (local) teacher models, under the constraints, that the student model does not have access to teacher models' parameters or training data. To evaluate the quality of knowledge transfer, we introduce a new metric, Semantic Distance (SD), that measures semantic closeness between the predicted and ground truth label distributions. The proposed method shows improvements in the global model's SD performance over the baseline across three NLP tasks while performing on par with Entropy-based distillation on standard accuracy and F1 metrics. The implementation pertaining to this work is publicly available at: https://github.com/declare-lab/KNOT.

Noise and uncertainty are usually the enemy of machine learning, noise in training data leads to uncertainty and inaccuracy in the predictions. However, we develop a machine learning architecture that extracts crucial information out of the noise itself to improve the predictions. The phenomenology computes and then utilizes uncertainty in one target variable to predict a second target variable. We apply this formalism to PbZr$_{0.7}$Sn$_{0.3}$O$_{3}$ crystal, using the uncertainty in dielectric constant to extrapolate heat capacity, correctly predicting a phase transition that otherwise cannot be extrapolated. For the second example -- single-particle diffraction of droplets -- we utilize the particle count together with its uncertainty to extrapolate the ground truth diffraction amplitude, delivering better predictions than when we utilize only the particle count. Our generic formalism enables the exploitation of uncertainty in machine learning, which has a broad range of applications in the physical sciences and beyond.

Deep Neural Networks (DNNs) have become an essential component in many application domains including web-based services. A variety of these services require high throughput and (close to) real-time features, for instance, to respond or react to users' requests or to process a stream of incoming data on time. However, the trend in DNN design is toward larger models with many layers and parameters to achieve more accurate results. Although these models are often pre-trained, the computational complexity in such large models can still be relatively significant, hindering low inference latency. Implementing a caching mechanism is a typical systems engineering solution for speeding up a service response time. However, traditional caching is often not suitable for DNN-based services. In this paper, we propose an end-to-end automated solution to improve the performance of DNN-based services in terms of their computational complexity and inference latency. Our caching method adopts the ideas of self-distillation of DNN models and early exits. The proposed solution is an automated online layer caching mechanism that allows early exiting of a large model during inference time if the cache model in one of the early exits is confident enough for final prediction. One of the main contributions of this paper is that we have implemented the idea as an online caching, meaning that the cache models do not need access to training data and perform solely based on the incoming data at run-time, making it suitable for applications using pre-trained models. Our experiments results on two downstream tasks (face and object classification) show that, on average, caching can reduce the computational complexity of those services up to 58\% (in terms of FLOPs count) and improve their inference latency up to 46\% with low to zero reduction in accuracy.

Lung cancer is the leading cause of cancer related mortality by a significant margin. While new technologies, such as image segmentation, have been paramount to improved detection and earlier diagnoses, there are still significant challenges in treating the disease. In particular, despite an increased number of curative resections, many postoperative patients still develop recurrent lesions. Consequently, there is a significant need for prognostic tools that can more accurately predict a patient's risk for recurrence. In this paper, we explore the use of convolutional neural networks (CNNs) for the segmentation and recurrence risk prediction of lung tumors that are present in preoperative computed tomography (CT) images. First, expanding upon recent progress in medical image segmentation, a residual U-Net is used to localize and characterize each nodule. Then, the identified tumors are passed to a second CNN for recurrence risk prediction. The system's final results are produced with a random forest classifier that synthesizes the predictions of the second network with clinical attributes. The segmentation stage uses the LIDC-IDRI dataset and achieves a dice score of 70.3%. The recurrence risk stage uses the NLST dataset from the National Cancer institute and achieves an AUC of 73.0%. Our proposed framework demonstrates that first, automated nodule segmentation methods can generalize to enable pipelines for a wide range of multitask systems and second, that deep learning and image processing have the potential to improve current prognostic tools. To the best of our knowledge, it is the first fully automated segmentation and recurrence risk prediction system.

Self-supervised learning (SSL) has emerged as a desirable paradigm in computer vision due to the inability of supervised models to learn representations that can generalize in domains with limited labels. The recent popularity of SSL has led to the development of several models that make use of diverse training strategies, architectures, and data augmentation policies with no existing unified framework to study or assess their effectiveness in transfer learning. We propose a data-driven geometric strategy to analyze different SSL models using local neighborhoods in the feature space induced by each. Unlike existing approaches that consider mathematical approximations of the parameters, individual components, or optimization landscape, our work aims to explore the geometric properties of the representation manifolds learned by SSL models. Our proposed manifold graph metrics (MGMs) provide insights into the geometric similarities and differences between available SSL models, their invariances with respect to specific augmentations, and their performances on transfer learning tasks. Our key findings are two fold: (i) contrary to popular belief, the geometry of SSL models is not tied to its training paradigm (contrastive, non-contrastive, and cluster-based); (ii) we can predict the transfer learning capability for a specific model based on the geometric properties of its semantic and augmentation manifolds.

We present a data-driven algorithm that advertisers can use to automate their digital ad-campaigns at online publishers. The algorithm enables the advertiser to search across available target audiences and ad-media to find the best possible combination for its campaign via online experimentation. The problem of finding the best audience-ad combination is complicated by a number of distinctive challenges, including (a) a need for active exploration to resolve prior uncertainty and to speed the search for profitable combinations, (b) many combinations to choose from, giving rise to high-dimensional search formulations, and (c) very low success probabilities, typically just a fraction of one percent. Our algorithm (designated LRDL, an acronym for Logistic Regression with Debiased Lasso) addresses these challenges by combining four elements: a multiarmed bandit framework for active exploration; a Lasso penalty function to handle high dimensionality; an inbuilt debiasing kernel that handles the regularization bias induced by the Lasso; and a semi-parametric regression model for outcomes that promotes cross-learning across arms. The algorithm is implemented as a Thompson Sampler, and to the best of our knowledge, it is the first that can practically address all of the challenges above. Simulations with real and synthetic data show the method is effective and document its superior performance against several benchmarks from the recent high-dimensional bandit literature.

Pruning is one of the predominant approaches for compressing deep neural networks (DNNs). Lately, coresets (provable data summarizations) were leveraged for pruning DNNs, adding the advantage of theoretical guarantees on the trade-off between the compression rate and the approximation error. However, coresets in this domain were either data-dependent or generated under restrictive assumptions on both the model's weights and inputs. In real-world scenarios, such assumptions are rarely satisfied, limiting the applicability of coresets. To this end, we suggest a novel and robust framework for computing such coresets under mild assumptions on the model's weights and without any assumption on the training data. The idea is to compute the importance of each neuron in each layer with respect to the output of the following layer. This is achieved by a combination of L\"{o}wner ellipsoid and Caratheodory theorem. Our method is simultaneously data-independent, applicable to various networks and datasets (due to the simplified assumptions), and theoretically supported. Experimental results show that our method outperforms existing coreset based neural pruning approaches across a wide range of networks and datasets. For example, our method achieved a $62\%$ compression rate on ResNet50 on ImageNet with $1.09\%$ drop in accuracy.

Substantial scholarship has estimated the susceptibility of jobs to automation, but little has examined how job contents evolve in the information age as new technologies substitute for tasks, shifting required skills rather than eliminating entire jobs. Here we explore the patterns and consequences of changes in occupational skill contents and characterize occupations and workers subject to the greatest re-skilling pressure. Recent research suggests that high-skilled STEM and technology-intensive occupations have experienced the highest rates of skill content change. Analyzing 727 occupations across 167 million job posts covering the near-universe of the U.S. online labor market between 2010 and 2018, we find that when skill distance is accounted for, re-skilling pressure is much higher for low-skilled occupations, no matter how "low-skill: is defined, either by skill number, pay level, or education degree. We investigate the implications of uneven occupational skill change on workers and find that those from large labor markets and large employers experienced less change, while non-white males in low-skill jobs are the most demographically vulnerable. We conclude by discussing the broad potential of our skill embedding model, which learns skill proximity from skill co-presence across job posts and represents it as distance in the high-dimensional space of complex human capital that corresponds with skilling costs for workers. This model offers a fine-grained measure of the extent to which jobs evolve, and also indicates in what direction job are evolving, as illustrated by the decline in demand for human-interface skills and the rise for those at the machine-interface.

Membership inference (MI) attacks highlight a privacy weakness in present stochastic training methods for neural networks. It is not well understood, however, why they arise. Are they a natural consequence of imperfect generalization only? Which underlying causes should we address during training to mitigate these attacks? Towards answering such questions, we propose the first approach to explain MI attacks and their connection to generalization based on principled causal reasoning. We offer causal graphs that quantitatively explain the observed MI attack performance achieved for $6$ attack variants. We refute several prior non-quantitative hypotheses that over-simplify or over-estimate the influence of underlying causes, thereby failing to capture the complex interplay between several factors. Our causal models also show a new connection between generalization and MI attacks via their shared causal factors. Our causal models have high predictive power ($0.90$), i.e., their analytical predictions match with observations in unseen experiments often, which makes analysis via them a pragmatic alternative.

Background: The field of software testing is growing and rapidly-evolving. Aims: Based on keywords assigned to publications, we seek to identify predominant research topics and understand how they are connected and have evolved. Method: We apply co-word analysis to map the topology of testing research as a network where author-assigned keywords are connected by edges indicating co-occurrence in publications. Keywords are clustered based on edge density and frequency of connection. We examine the most popular keywords, summarize clusters into high-level research topics, examine how topics connect, and examine how the field is changing. Results: Testing research can be divided into 16 high-level topics and 18 subtopics. Creation guidance, automated test generation, evolution and maintenance, and test oracles have particularly strong connections to other topics, highlighting their multidisciplinary nature. Emerging keywords relate to web and mobile apps, machine learning, energy consumption, automated program repair and test generation, while emerging connections have formed between web apps, test oracles, and machine learning with many topics. Random and requirements-based testing show potential decline. Conclusions: Our observations, advice, and map data offer a deeper understanding of the field and inspiration regarding challenges and connections to explore.

In this work, we present a new dataset and a computational strategy for a digital coach that aims to guide users in practicing the protocols of self-attachment therapy. Our framework augments a rule-based conversational agent with a deep-learning classifier for identifying the underlying emotion in a user's text response, as well as a deep-learning assisted retrieval method for producing novel, fluent and empathetic utterances. We also craft a set of human-like personas that users can choose to interact with. Our goal is to achieve a high level of engagement during virtual therapy sessions. We evaluate the effectiveness of our framework in a non-clinical trial with N=16 participants, all of whom have had at least four interactions with the agent over the course of five days. We find that our platform is consistently rated higher for empathy, user engagement and usefulness than the simple rule-based framework. Finally, we provide guidelines to further improve the design and performance of the application, in accordance with the feedback received.

In this paper, we advocate for two stages in a neural network's decision making process. The first is the existing feed-forward inference framework where patterns in given data are sensed and associated with previously learned patterns. The second stage is a slower reflection stage where we ask the network to reflect on its feed-forward decision by considering and evaluating all available choices. Together, we term the two stages as introspective learning. We use gradients of trained neural networks as a measurement of this reflection. A simple three-layered Multi Layer Perceptron is used as the second stage that predicts based on all extracted gradient features. We perceptually visualize the post-hoc explanations from both stages to provide a visual grounding to introspection. For the application of recognition, we show that an introspective network is 4% more robust and 42% less prone to calibration errors when generalizing to noisy data. We also illustrate the value of introspective networks in downstream tasks that require generalizability and calibration including active learning, out-of-distribution detection, and uncertainty estimation. Finally, we ground the proposed machine introspection to human introspection for the application of image quality assessment.

The Jensen-Shannon divergence is a renown bounded symmetrization of the unbounded Kullback-Leibler divergence which measures the total Kullback-Leibler divergence to the average mixture distribution. However the Jensen-Shannon divergence between Gaussian distributions is not available in closed-form. To bypass this problem, we present a generalization of the Jensen-Shannon (JS) divergence using abstract means which yields closed-form expressions when the mean is chosen according to the parametric family of distributions. More generally, we define the JS-symmetrizations of any distance using generalized statistical mixtures derived from abstract means. In particular, we first show that the geometric mean is well-suited for exponential families, and report two closed-form formula for (i) the geometric Jensen-Shannon divergence between probability densities of the same exponential family, and (ii) the geometric JS-symmetrization of the reverse Kullback-Leibler divergence. As a second illustrating example, we show that the harmonic mean is well-suited for the scale Cauchy distributions, and report a closed-form formula for the harmonic Jensen-Shannon divergence between scale Cauchy distributions. We also define generalized Jensen-Shannon divergences between matrices (e.g., quantum Jensen-Shannon divergences) and consider clustering with respect to these novel Jensen-Shannon divergences.

Natural language modeling with limited training data is a challenging problem, and many algorithms make use of large-scale pretrained language models (PLMs) for this due to its great generalization ability. Among them, additive learning that incorporates a task-specific adapter on top of the fixed large-scale PLM has been popularly used in the few-shot setting. However, this added adapter is still easy to disregard the knowledge of the PLM especially for few-shot natural language generation (NLG) since an entire sequence is usually generated by only the newly trained adapter. Therefore, in this work, we develop a novel additive learning algorithm based on reinforcement learning (RL) that selectively outputs language tokens between the task-general PLM and the task-specific adapter during both training and inference. This output token selection over the two generators allows the adapter to take into account solely the task-relevant parts in sequence generation, and therefore makes it more robust to overfitting as well as more stable in RL training. In addition, to obtain the complementary adapter from the PLM for each few-shot task, we exploit a separate selecting module that is also simultaneously trained using RL. Experimental results on various few-shot NLG tasks including question answering, data-to-text generation and text summarization demonstrate that the proposed selective token generation significantly outperforms the previous additive learning algorithms based on the PLMs.

We introduce a neural stack architecture, including a differentiable parametrized stack operator that approximates stack push and pop operations for suitable choices of parameters that explicitly represents a stack. We prove the stability of this stack architecture: after arbitrarily many stack operations, the state of the neural stack still closely resembles the state of the discrete stack. Using the neural stack with a recurrent neural network, we introduce a neural network Pushdown Automaton (nnPDA) and prove that nnPDA with finite/bounded neurons and time can simulate any PDA. Furthermore, we extend our construction and propose new architecture neural state Turing Machine (nnTM). We prove that differentiable nnTM with bounded neurons can simulate Turing Machine (TM) in real-time. Just like the neural stack, these architectures are also stable. Finally, we extend our construction to show that differentiable nnTM is equivalent to Universal Turing Machine (UTM) and can simulate any TM with only \textbf{seven finite/bounded precision} neurons. This work provides a new theoretical bound for the computational capability of bounded precision RNNs augmented with memory.

We consider regret minimization for Adversarial Markov Decision Processes (AMDPs), where the loss functions are changing over time and adversarially chosen, and the learner only observes the losses for the visited state-action pairs (i.e., bandit feedback). While there has been a surge of studies on this problem using Online-Mirror-Descent (OMD) methods, very little is known about the Follow-the-Perturbed-Leader (FTPL) methods, which are usually computationally more efficient and also easier to implement since it only requires solving an offline planning problem. Motivated by this, we take a closer look at FTPL for learning AMDPs, starting from the standard episodic finite-horizon setting. We find some unique and intriguing difficulties in the analysis and propose a workaround to eventually show that FTPL is also able to achieve near-optimal regret bounds in this case. More importantly, we then find two significant applications: First, the analysis of FTPL turns out to be readily generalizable to delayed bandit feedback with order-optimal regret, while OMD methods exhibit extra difficulties (Jin et al., 2022). Second, using FTPL, we also develop the first no-regret algorithm for learning communicating AMDPs in the infinite-horizon setting with bandit feedback and stochastic transitions. Our algorithm is efficient assuming access to an offline planning oracle, while even for the easier full-information setting, the only existing algorithm (Chandrasekaran and Tewari, 2021) is computationally inefficient.

Assuming a known degradation model, the performance of a learned image super-resolution (SR) model depends on how well the variety of image characteristics within the training set matches those in the test set. As a result, the performance of an SR model varies noticeably from image to image over a test set depending on whether characteristics of specific images are similar to those in the training set or not. Hence, in general, a single SR model cannot generalize well enough for all types of image content. In this work, we show that training multiple SR models for different classes of images (e.g., for text, texture, etc.) to exploit class-specific image priors and employing a post-processing network that learns how to best fuse the outputs produced by these multiple SR models surpasses the performance of state-of-the-art generic SR models. Experimental results clearly demonstrate that the proposed multiple-model SR (MMSR) approach significantly outperforms a single pre-trained state-of-the-art SR model both quantitatively and visually. It even exceeds the performance of the best single class-specific SR model trained on similar text or texture images.

Heterogeneous big data poses many challenges in machine learning. Its enormous scale, high dimensionality, and inherent uncertainty make almost every aspect of machine learning difficult, from providing enough processing power to maintaining model accuracy to protecting privacy. However, perhaps the most imposing problem is that big data is often interspersed with sensitive personal data. Hence, we propose a privacy-preserving hierarchical fuzzy neural network (PP-HFNN) to address these technical challenges while also alleviating privacy concerns. The network is trained with a two-stage optimization algorithm, and the parameters at low levels of the hierarchy are learned with a scheme based on the well-known alternating direction method of multipliers, which does not reveal local data to other agents. Coordination at high levels of the hierarchy is handled by the alternating optimization method, which converges very quickly. The entire training procedure is scalable, fast and does not suffer from gradient vanishing problems like the methods based on back-propagation. Comprehensive simulations conducted on both regression and classification tasks demonstrate the effectiveness of the proposed model.

In populous countries, pending legal cases have been growing exponentially. There is a need for developing techniques for processing and organizing legal documents. In this paper, we introduce a new corpus for structuring legal documents. In particular, we introduce a corpus of legal judgment documents in English that are segmented into topical and coherent parts. Each of these parts is annotated with a label coming from a list of pre-defined Rhetorical Roles. We develop baseline models for automatically predicting rhetorical roles in a legal document based on the annotated corpus. Further, we show the application of rhetorical roles to improve performance on the tasks of summarization and legal judgment prediction. We release the corpus and baseline model code along with the paper.

We study a type of Online Linear Programming (OLP) problem that maximizes the objective function with stochastic inputs. The performance of various algorithms that analyze this type of OLP is well studied when the stochastic inputs follow some i.i.d distribution. The two central questions to ask are: (i) can the algorithms achieve the same efficiency if the stochastic inputs are not i.i.d but still stationary, and (ii) how can we modify our algorithms if we know the stochastic inputs are trendy, hence not stationary. We answer the first question by analyzing a regenerative type of input and show the regret of two popular algorithms are bounded by the same order as their i.i.d counterpart. We discuss the second question in the context of linearly growing inputs and propose two trend-adaptive algorithms. We provide numerical simulations to illustrate the performance of our algorithms under both regenerative and trendy inputs.

Currently there exists rather promising new trend in machine leaning (ML) based on the relationship between neural networks (NN) and Gaussian processes (GP), including many related subtopics, e.g., signal propagation in NNs, theoretical derivation of learning curve for NNs, QFT methods in ML, etc. An important feature of convolutional neural networks (CNN) is their equivariance (consistency) with respect to the symmetry transformations of the input data. In this work we establish a relationship between the many-channel limit for CNNs equivariant with respect to two-dimensional Euclidean group with vector-valued neuron activations and the corresponding independently introduced equivariant Gaussian processes (GP).

We design and analyse quantum transformers, extending the state-of-the-art classical transformer neural network architectures known to be very performant in natural language processing and image analysis. Building upon the previous work of parametrised quantum circuits for data loading and orthogonal neural layers, we introduce three quantum attention mechanisms, including a quantum transformer based on compound matrices. These quantum architectures can be built using shallow quantum circuits and can provide qualitatively different classification models. We performed extensive simulations of the quantum transformers on standard medical image datasets that showed competitive, and at times better, performance compared with the best classical transformers and other classical benchmarks. The computational complexity of our quantum attention layer proves to be advantageous compared with the classical algorithm with respect to the size of the classified images. Our quantum architectures have thousands of parameters compared with the best classical methods with millions of parameters. Finally, we have implemented our quantum transformers on superconducting quantum computers and obtained encouraging results for up to six qubit experiments.

This paper introduces Honor of Kings Arena, a reinforcement learning (RL) environment based on Honor of Kings, one of the world's most popular games at present. Compared to other environments studied in most previous work, ours presents new generalization challenges for competitive reinforcement learning. It is a multi-agent problem with one agent competing against its opponent; and it requires the generalization ability as it has diverse targets to control and diverse opponents to compete with. We describe the observation, action, and reward specifications for the Honor of Kings domain and provide an open-source Python-based interface for communicating with the game engine. We provide twenty target heroes with a variety of tasks in Honor of Kings Arena and present initial baseline results for RL-based methods with feasible computing resources. Finally, we showcase the generalization challenges imposed by Honor of Kings Arena and possible remedies to the challenges. All of the software, including the environment-class, are publicly available at https://github.com/tencent-ailab/hok_env . The documentation is available at https://aiarena.tencent.com/hok/doc/ .

Probabilistic models of language understanding are interpretable and structured, for instance models of metaphor understanding describe inference about latent topics and features. However, these models are manually designed for a specific task. Large language models (LLMs) can perform many tasks through in-context learning, but they lack the clear structure of probabilistic models. In this paper, we use chain-of-thought prompts to introduce structures from probabilistic models into LLMs. These prompts lead the model to infer latent variables and reason about their relationships to choose appropriate paraphrases for metaphors. The latent variables and relationships chosen are informed by theories of metaphor understanding from cognitive psychology. We apply these prompts to the two largest versions of GPT-3 and show that they can improve paraphrase selection.

Color image denoising is frequently encountered in various image processing and computer vision tasks. One traditional strategy is to convert the RGB image to a less correlated color space and denoise each channel of the new space separately. However, such a strategy can not fully exploit the correlated information between channels and is inadequate to obtain satisfactory results. To address this issue, this paper proposes a new multi-channel optimization model for color image denoising under the nuclear norm minus Frobenius norm minimization framework. Specifically, based on the block-matching, the color image is decomposed into overlapping RGB patches. For each patch, we stack its similar neighbors to form the corresponding patch matrix. The proposed model is performed on the patch matrix to recover its noise-free version. During the recovery process, a) a weight matrix is introduced to fully utilize the noise difference between channels; b) the singular values are shrunk adaptively without additionally assigning weights. With them, the proposed model can achieve promising results while keeping simplicity. To solve the proposed model, an accurate and effective algorithm is built based on the alternating direction method of multipliers framework. The solution of each updating step can be analytically expressed in closed-from. Rigorous theoretical analysis proves the solution sequences generated by the proposed algorithm converge to their respective stationary points. Experimental results on both synthetic and real noise datasets demonstrate the proposed model outperforms state-of-the-art models.

In many scenarios, it is necessary to monitor a complex system via a time-series of observations and determine when anomalous exogenous events have occurred so that relevant actions can be taken. Determining whether current observations are abnormal is challenging. It requires learning an extrapolative probabilistic model of the dynamics from historical data, and using a limited number of current observations to make a classification. We leverage recent advances in long-term probabilistic forecasting, namely {\em Deep Probabilistic Koopman}, to build a general method for classifying anomalies in multi-dimensional time-series data. We also show how to utilize models with domain knowledge of the dynamics to reduce type I and type II error. We demonstrate our proposed method on the important real-world task of global atmospheric pollution monitoring, integrating it with NASA's Global Earth System Model. The system successfully detects localized anomalies in air quality due to events such as COVID-19 lockdowns and wildfires.

Mixtures of experts (MoE) models are a popular framework for modeling heterogeneity in data, for both regression and classification problems in statistics and machine learning, due to their flexibility and the abundance of available statistical estimation and model choice tools. Such flexibility comes from allowing the mixture weights (or gating functions) in the MoE model to depend on the explanatory variables, along with the experts (or component densities). This permits the modeling of data arising from more complex data generating processes when compared to the classical finite mixtures and finite mixtures of regression models, whose mixing parameters are independent of the covariates. The use of MoE models in a high-dimensional setting, when the number of explanatory variables can be much larger than the sample size, is challenging from a computational point of view, and in particular from a theoretical point of view, where the literature is still lacking results for dealing with the curse of dimensionality, for both the statistical estimation and feature selection problems. We consider the finite MoE model with soft-max gating functions and Gaussian experts for high-dimensional regression on heterogeneous data, and its $l_1$-regularized estimation via the Lasso. We focus on the Lasso estimation properties rather than its feature selection properties. We provide a lower bound on the regularization parameter of the Lasso function that ensures an $l_1$-oracle inequality satisfied by the Lasso estimator according to the Kullback--Leibler loss.

Stock prices move as piece-wise trending fluctuation rather than a purely random walk. Traditionally, the prediction of future stock movements is based on the historical trading record. Nowadays, with the development of social media, many active participants in the market choose to publicize their strategies, which provides a window to glimpse over the whole market's attitude towards future movements by extracting the semantics behind social media. However, social media contains conflicting information and cannot replace historical records completely. In this work, we propose a multi-modality attention network to reduce conflicts and integrate semantic and numeric features to predict future stock movements comprehensively. Specifically, we first extract semantic information from social media and estimate their credibility based on posters' identity and public reputation. Then we incorporate the semantic from online posts and numeric features from historical records to make the trading strategy. Experimental results show that our approach outperforms previous methods by a significant margin in both prediction accuracy (61.20\%) and trading profits (9.13\%). It demonstrates that our method improves the performance of stock movements prediction and informs future research on multi-modality fusion towards stock prediction.

In this paper, we present a new policy gradient (PG) methods, namely the block policy mirror descent (BPMD) method for solving a class of regularized reinforcement learning (RL) problems with (strongly)-convex regularizers. Compared to the traditional PG methods with a batch update rule, which visits and updates the policy for every state, BPMD method has cheap per-iteration computation via a partial update rule that performs the policy update on a sampled state. Despite the nonconvex nature of the problem and a partial update rule, we provide a unified analysis for several sampling schemes, and show that BPMD achieves fast linear convergence to the global optimality. In particular, uniform sampling leads to comparable worst-case total computational complexity as batch PG methods. A necessary and sufficient condition for convergence with on-policy sampling is also identified. With a hybrid sampling scheme, we further show that BPMD enjoys potential instance-dependent acceleration, leading to improved dependence on the state space and consequently outperforming batch PG methods. We then extend BPMD methods to the stochastic setting, by utilizing stochastic first-order information constructed from samples. With a generative model, $\tilde{\mathcal{O}}(\left\lvert \mathcal{S}\right\rvert \left\lvert \mathcal{A}\right\rvert /\epsilon)$ (resp. $\tilde{\mathcal{O}}(\left\lvert \mathcal{S}\right\rvert \left\lvert \mathcal{A} \right\rvert /\epsilon^2)$) sample complexities are established for the strongly-convex (resp. non-strongly-convex) regularizers, where $\epsilon$ denotes the target accuracy. To the best of our knowledge, this is the first time that block coordinate descent methods have been developed and analyzed for policy optimization in reinforcement learning, which provides a new perspective on solving large-scale RL problems.

Causal discovery for quantitative data has been extensively studied but less is known for categorical data. We propose a novel causal model for categorical data based on a new classification model, termed classification with optimal label permutation (COLP). By design, COLP is a parsimonious classifier, which gives rise to a provably identifiable causal model. A simple learning algorithm via comparing likelihood functions of causal and anti-causal models suffices to learn the causal direction. Through experiments with synthetic and real data, we demonstrate the favorable performance of the proposed COLP-based causal model compared to state-of-the-art methods. We also make available an accompanying R package COLP, which contains the proposed causal discovery algorithm and a benchmark dataset of categorical cause-effect pairs.

Domain generalization (DG) aims to learn a model on several source domains, hoping that the model can generalize well to unseen target domains. The distribution shift between domains contains the covariate shift and conditional shift, both of which the model must be able to handle for better generalizability. In this paper, a novel DG method is proposed to deal with the distribution shift via Visual Alignment and Uncertainty-guided belief Ensemble (VAUE). Specifically, for the covariate shift, a visual alignment module is designed to align the distribution of image style to a common empirical Gaussian distribution so that the covariate shift can be eliminated in the visual space. For the conditional shift, we adopt an uncertainty-guided belief ensemble strategy based on the subjective logic and Dempster-Shafer theory. The conditional distribution given a test sample is estimated by the dynamic combination of that of source domains. Comprehensive experiments are conducted to demonstrate the superior performance of the proposed method on four widely used datasets, i.e., Office-Home, VLCS, TerraIncognita, and PACS.

Recently, self-learning methods based on user satisfaction metrics and contextual bandits have shown promising results to enable consistent improvements in conversational AI systems. However, directly targeting such metrics by off-policy bandit learning objectives often increases the risk of making abrupt policy changes that break the current user experience. In this study, we introduce a scalable framework for supporting fine-grained exploration targets for individual domains via user-defined constraints. For example, we may want to ensure fewer policy deviations in business-critical domains such as shopping, while allocating more exploration budget to domains such as music. Furthermore, we present a novel meta-gradient learning approach that is scalable and practical to address this problem. The proposed method adjusts constraint violation penalty terms adaptively through a meta objective that encourages balanced constraint satisfaction across domains. We conduct extensive experiments using data from a real-world conversational AI on a set of realistic constraint benchmarks. Based on the experimental results, we demonstrate that the proposed approach is capable of achieving the best balance between the policy value and constraint satisfaction rate.

Kratom (KT) typically exerts antidepressant (AD) effects. However, evaluating which form of KT extracts possesses AD properties similar to the standard AD fluoxetine (flu) remained challenging. Here, we adopted an autoencoder (AE)-based anomaly detector called ANet to measure the similarity of mice's local field potential (LFP) features that responded to KT leave extracts and AD flu. The features that responded to KT syrup had the highest similarity to those that responded to the AD flu at 85.62 $\pm$ 0.29%. This finding presents the higher feasibility of using KT syrup as an alternative substance for depressant therapy than KT alkaloids and KT aqueous, which are the other candidates in this study. Apart from the similarity measurement, we utilized ANet as a multi-task AE and evaluated the performance in discriminating multi-class LFP responses corresponding to the effect of different KT extracts and AD flu simultaneously. Furthermore, we visualized learned latent features among LFP responses qualitatively and quantitatively as t-SNE projection and maximum mean discrepancy distance, respectively. The classification results reported the accuracy and F1-score of 79.78 $\pm$ 0.39% and 79.53 $\pm$ 0.00%. In summary, the outcomes of this research might help therapeutic design devices for an alternative substance profile evaluation, such as Kratom-based form in real-world applications.

Robustness is becoming another important challenge of federated learning in that the data collection process in each client is naturally accompanied by noisy labels. However, it is far more complex and challenging owing to varying levels of data heterogeneity and noise over clients, which exacerbates the client-to-client performance discrepancy. In this work, we propose a robust federated learning method called FedRN, which exploits k-reliable neighbors with high data expertise or similarity. Our method helps mitigate the gap between low- and high-performance clients by training only with a selected set of clean examples, identified by their ensembled mixture models. We demonstrate the superiority of FedRN via extensive evaluations on three real-world or synthetic benchmark datasets. Compared with existing robust training methods, the results show that FedRN significantly improves the test accuracy in the presence of noisy labels.

Flow-based generative super-resolution (SR) models learn to produce a diverse set of feasible SR solutions, called the SR space. Diversity of SR solutions increases with the temperature ($\tau$) of latent variables, which introduces random variations of texture among sample solutions, resulting in visual artifacts and low fidelity. In this paper, we present a simple but effective image ensembling/fusion approach to obtain a single SR image eliminating random artifacts and improving fidelity without significantly compromising perceptual quality. We achieve this by benefiting from a diverse set of feasible photo-realistic solutions in the SR space spanned by flow models. We propose different image ensembling and fusion strategies which offer multiple paths to move sample solutions in the SR space to more desired destinations in the perception-distortion plane in a controllable manner depending on the fidelity vs. perceptual quality requirements of the task at hand. Experimental results demonstrate that our image ensembling/fusion strategy achieves more promising perception-distortion trade-off compared to sample SR images produced by flow models and adversarially trained models in terms of both quantitative metrics and visual quality.

Imaging of facial affects may be used to measure psychophysiological attributes of children through their adulthood, especially for monitoring lifelong conditions like Autism Spectrum Disorder. Deep convolutional neural networks have shown promising results in classifying facial expressions of adults. However, classifier models trained with adult benchmark data are unsuitable for learning child expressions due to discrepancies in psychophysical development. Similarly, models trained with child data perform poorly in adult expression classification. We propose domain adaptation to concurrently align distributions of adult and child expressions in a shared latent space to ensure robust classification of either domain. Furthermore, age variations in facial images are studied in age-invariant face recognition yet remain unleveraged in adult-child expression classification. We take inspiration from multiple fields and propose deep adaptive FACial Expressions fusing BEtaMix SElected Landmark Features (FACE-BE-SELF) for adult-child facial expression classification. For the first time in the literature, a mixture of Beta distributions is used to decompose and select facial features based on correlations with expression, domain, and identity factors. We evaluate FACE-BE-SELF on two pairs of adult-child data sets. Our proposed FACE-BE-SELF approach outperforms adult-child transfer learning and other baseline domain adaptation methods in aligning latent representations of adult and child expressions.

The growing use of probe vehicles generates a huge number of GNSS data. Limited by the satellite positioning technology, further improving the accuracy of map-matching is challenging work, especially for low-frequency trajectories. When matching a trajectory, the ego vehicle's spatial-temporal information of the present trip is the most useful with the least amount of data. In addition, there are a large amount of other data, e.g., other vehicles' state and past prediction results, but it is hard to extract useful information for matching maps and inferring paths. Most map-matching studies only used the ego vehicle's data and ignored other vehicles' data. Based on it, this paper designs a new map-matching method to make full use of "Big data". We first sort all data into four groups according to their spatial and temporal distance from the present matching probe which allows us to sort for their usefulness. Then we design three different methods to extract valuable information (scores) from them: a score for speed and bearing, a score for historical usage, and a score for traffic state using the spectral graph Markov neutral network. Finally, we use a modified top-K shortest-path method to search the candidate paths within an ellipse region and then use the fused score to infer the path (projected location). We test the proposed method against baseline algorithms using a real-world dataset in China. The results show that all scoring methods can enhance map-matching accuracy. Furthermore, our method outperforms the others, especially when GNSS probing frequency is less than 0.01 Hz.

The random Fourier features (RFFs) method is a powerful and popular technique in kernel approximation for scalability of kernel methods. The theoretical foundation of RFFs is based on the Bochner theorem that relates symmetric, positive definite (PD) functions to probability measures. This condition naturally excludes asymmetric functions with a wide range applications in practice, e.g., directed graphs, conditional probability, and asymmetric kernels. Nevertheless, understanding asymmetric functions (kernels) and its scalability via RFFs is unclear both theoretically and empirically. In this paper, we introduce a complex measure with the real and imaginary parts corresponding to four finite positive measures, which expands the application scope of the Bochner theorem. By doing so, this framework allows for handling classical symmetric, PD kernels via one positive measure; symmetric, non-positive definite kernels via signed measures; and asymmetric kernels via complex measures, thereby unifying them into a general framework by RFFs, named AsK-RFFs. Such approximation scheme via complex measures enjoys theoretical guarantees in the perspective of the uniform convergence. In algorithmic implementation, to speed up the kernel approximation process, which is expensive due to the calculation of total mass, we employ a subset-based fast estimation method that optimizes total masses on a sub-training set, which enjoys computational efficiency in high dimensions. Our AsK-RFFs method is empirically validated on several typical large-scale datasets and achieves promising kernel approximation performance, which demonstrate the effectiveness of AsK-RFFs.

Flocking control is a challenging problem, where multiple agents, such as drones or vehicles, need to reach a target position while maintaining the flock and avoiding collisions with obstacles and collisions among agents in the environment. Multi-agent reinforcement learning has achieved promising performance in flocking control. However, methods based on traditional reinforcement learning require a considerable number of interactions between agents and the environment. This paper proposes a sub-optimal policy aided multi-agent reinforcement learning algorithm (SPA-MARL) to boost sample efficiency. SPA-MARL directly leverages a prior policy that can be manually designed or solved with a non-learning method to aid agents in learning, where the performance of the policy can be sub-optimal. SPA-MARL recognizes the difference in performance between the sub-optimal policy and itself, and then imitates the sub-optimal policy if the sub-optimal policy is better. We leverage SPA-MARL to solve the flocking control problem. A traditional control method based on artificial potential fields is used to generate a sub-optimal policy. Experiments demonstrate that SPA-MARL can speed up the training process and outperform both the MARL baseline and the used sub-optimal policy.

Graph Neural Networks (GNNs) are popular machine learning methods for modeling graph data. A lot of GNNs perform well on homophily graphs while having unsatisfactory performance on heterophily graphs. Recently, some researchers turn their attention to designing GNNs for heterophily graphs by adjusting the message passing mechanism or enlarging the receptive field of the message passing. Different from existing works that mitigate the issues of heterophily from model design perspective, we propose to study heterophily graphs from an orthogonal perspective by rewiring the graph structure to reduce heterophily and making the traditional GNNs perform better. Through comprehensive empirical studies and analysis, we verify the potential of the rewiring methods. To fully exploit its potential, we propose a method named Deep Heterophily Graph Rewiring (DHGR) to rewire graphs by adding homophilic edges and pruning heterophilic edges. The detailed way of rewiring is determined by comparing the similarity of label/feature-distribution of node neighbors. Besides, we design a scalable implementation for DHGR to guarantee high efficiency. DHRG can be easily used as a plug-in module, i.e., a graph pre-processing step, for any GNNs, including both GNN for homophily and heterophily, to boost their performance on the node classification task. To the best of our knowledge, it is the first work studying graph rewiring for heterophily graphs. Extensive experiments on 11 public graph datasets demonstrate the superiority of our proposed methods.

In this paper we consider the possibility of computing rather than training the decision layer weights of a neural classifier. Such a possibility arises in two way, from making an appropriate choice of loss function and by solving a problem of constrained optimization. The latter formulation leads to a promising new learning process for pre-decision weights with both simplicity and efficacy.

We consider the problem of estimating the topology of multiple networks from nodal observations, where these networks are assumed to be drawn from the same (unknown) random graph model. We adopt a graphon as our random graph model, which is a nonparametric model from which graphs of potentially different sizes can be drawn. The versatility of graphons allows us to tackle the joint inference problem even for the cases where the graphs to be recovered contain different number of nodes and lack precise alignment across the graphs. Our solution is based on combining a maximum likelihood penalty with graphon estimation schemes and can be used to augment existing network inference methods. The proposed joint network and graphon estimation is further enhanced with the introduction of a robust method for noisy graph sampling information. We validate our proposed approach by comparing its performance against competing methods in synthetic and real-world datasets.

A core challenge for an autonomous agent acting in the real world is to adapt its repertoire of skills to cope with its noisy perception and dynamics. To scale learning of skills to long-horizon tasks, robots should be able to learn and later refine their skills in a structured manner through trajectories rather than making instantaneous decisions individually at each time step. To this end, we propose the Soft Actor-Critic Gaussian Mixture Model (SAC-GMM), a novel hybrid approach that learns robot skills through a dynamical system and adapts the learned skills in their own trajectory distribution space through interactions with the environment. Our approach combines classical robotics techniques of learning from demonstration with the deep reinforcement learning framework and exploits their complementary nature. We show that our method utilizes sensors solely available during the execution of preliminarily learned skills to extract relevant features that lead to faster skill refinement. Extensive evaluations in both simulation and real-world environments demonstrate the effectiveness of our method in refining robot skills by leveraging physical interactions, high-dimensional sensory data, and sparse task completion rewards. Videos, code, and pre-trained models are available at this http URL

Deployed machine learning (ML) models often encounter new user data that differs from their training data. Therefore, estimating how well a given model might perform on the new data is an important step toward reliable ML applications. This is very challenging, however, as the data distribution can change in flexible ways, and we may not have any labels on the new data, which is often the case in monitoring settings. In this paper, we propose a new distribution shift model, Sparse Joint Shift (SJS), which considers the joint shift of both labels and a few features. This unifies and generalizes several existing shift models including label shift and sparse covariate shift, where only marginal feature or label distribution shifts are considered. We describe mathematical conditions under which SJS is identifiable. We further propose SEES, an algorithmic framework to characterize the distribution shift under SJS and to estimate a model's performance on new data without any labels. We conduct extensive experiments on several real-world datasets with various ML models. Across different datasets and distribution shifts, SEES achieves significant (up to an order of magnitude) shift estimation error improvements over existing approaches.

Optimal scaling has been well studied for Metropolis-Hastings (M-H) algorithms in continuous spaces, but a similar understanding has been lacking in discrete spaces. Recently, a family of locally balanced proposals (LBP) for discrete spaces has been proved to be asymptotically optimal, but the question of optimal scaling has remained open. In this paper, we establish, for the first time, that the efficiency of M-H in discrete spaces can also be characterized by an asymptotic acceptance rate that is independent of the target distribution. Moreover, we verify, both theoretically and empirically, that the optimal acceptance rates for LBP and random walk Metropolis (RWM) are $0.574$ and $0.234$ respectively. These results also help establish that LBP is asymptotically $O(N^\frac{2}{3})$ more efficient than RWM with respect to model dimension $N$. Knowledge of the optimal acceptance rate allows one to automatically tune the neighborhood size of a proposal distribution in a discrete space, directly analogous to step-size control in continuous spaces. We demonstrate empirically that such adaptive M-H sampling can robustly improve sampling in a variety of target distributions in discrete spaces, including training deep energy based models.  ( 2 min )

Fairness testing aims at mitigating unintended discrimination in the decision-making process of data-driven AI systems. Individual discrimination may occur when an AI model makes different decisions for two distinct individuals who are distinguishable solely according to protected attributes, such as age and race. Such instances reveal biased AI behaviour, and are called Individual Discriminatory Instances (IDIs). In this paper, we propose an approach for the selection of the initial seeds to generate IDIs for fairness testing. Previous studies mainly used random initial seeds to this end. However this phase is crucial, as these seeds are the basis of the follow-up IDIs generation. We dubbed our proposed seed selection approach I&D. It generates a large number of initial IDIs exhibiting a great diversity, aiming at improving the overall performance of fairness testing. Our empirical study reveal that I&D is able to produce a larger number of IDIs with respect to four state-of-the-art seed generation approaches, generating 1.68X more IDIs on average. Moreover, we compare the use of I&D to train machine learning models and find that using I&D reduces the number of remaining IDIs by 29% when compared to the state-of-the-art, thus indicating that I&D is effective for improving model fairness  ( 2 min )

A significant percentage of COVID-19 survivors experience ongoing multisystemic symptoms that often affect daily living, a condition known as Long Covid or post-acute-sequelae of SARS-CoV-2 infection. However, identifying Long Covid articles is challenging since articles refer to the condition using a variety of less common terms or refrain from naming it at all. We developed an iterative human-in-the-loop machine learning framework designed to effectively leverage the data available and make the most efficient use of human labels. Specifically, our approach combines data programming with active learning into a robust ensemble model. Evaluating our model on a holdout set demonstrates over three times the sensitivity of other methods. We apply our model to PubMed to create the Long Covid collection, and demonstrate that (1) most Long Covid articles do not refer to Long Covid by any name (2) when the condition is named, the name used most frequently in the biomedical literature is Long Covid, and (3) Long Covid is associated with disorders in a wide variety of body systems. The Long Covid collection is updated weekly and is searchable online at the LitCovid portal: https://www.ncbi.nlm.nih.gov/research/coronavirus/docsum?filters=e_condition.LongCovid  ( 3 min )

Predictions and forecasts of machine learning models should take the form of probability distributions, aiming to increase the quantity of information communicated to end users. Although applications of probabilistic prediction and forecasting with machine learning models in academia and industry are becoming more frequent, related concepts and methods have not been formalized and structured under a holistic view of the entire field. Here, we review the topic of predictive uncertainty estimation with machine learning algorithms, as well as the related metrics (consistent scoring functions and proper scoring rules) for assessing probabilistic predictions. The review covers a time period spanning from the introduction of early statistical (linear regression and time series models, based on Bayesian statistics or quantile regression) to recent machine learning algorithms (including generalized additive models for location, scale and shape, random forests, boosting and deep learning algorithms) that are more flexible by nature. The review of the progress in the field, expedites our understanding on how to develop new algorithms tailored to users' needs, since the latest advancements are based on some fundamental concepts applied to more complex algorithms. We conclude by classifying the material and discussing challenges that are becoming a hot topic of research.  ( 2 min )

State estimation is an important aspect in many robotics applications. In this work, we consider the task of obtaining accurate state estimates for robotic systems by enhancing the dynamics model used in state estimation algorithms. Existing frameworks such as moving horizon estimation (MHE) and the unscented Kalman filter (UKF) provide the flexibility to incorporate nonlinear dynamics and measurement models. However, this implies that the dynamics model within these algorithms has to be sufficiently accurate in order to warrant the accuracy of the state estimates. To enhance the dynamics models and improve the estimation accuracy, we utilize a deep learning framework known as knowledge-based neural ordinary differential equations (KNODEs). The KNODE framework embeds prior knowledge into the training procedure and synthesizes an accurate hybrid model by fusing a prior first-principles model with a neural ordinary differential equation (NODE) model. In our proposed LEARNEST framework, we integrate the data-driven model into two novel model-based state estimation algorithms, which are denoted as KNODE-MHE and KNODE-UKF. These two algorithms are compared against their conventional counterparts across a number of robotic applications; state estimation for a cartpole system using partial measurements, localization for a ground robot, as well as state estimation for a quadrotor. Through simulations and tests using real-world experimental data, we demonstrate the versatility and efficacy of the proposed learning-enhanced state estimation framework.  ( 3 min )

We propose a new data augmentation technique for semi-supervised learning settings that emphasizes learning from the most challenging regions of the feature space. Starting with a fully supervised reference model, we first identify low confidence predictions. These samples are then used to train a Variational AutoEncoder (VAE) that can generate an infinite number of additional images with similar distribution. Finally, using the originally labeled data and the synthetically generated labeled and unlabeled data, we retrain a new model in a semi-supervised fashion. We perform experiments on two benchmark RGB datasets: CIFAR-100 and STL-10, and show that the proposed scheme improves classification performance in terms of accuracy and robustness, while yielding comparable or superior results with respect to existing fully supervised approaches  ( 2 min )

We introduce De Bruijn Graph Neural Networks (DBGNNs), a novel time-aware graph neural network architecture for time-resolved data on dynamic graphs. Our approach accounts for temporal-topological patterns that unfold in the causal topology of dynamic graphs, which is determined by causal walks, i.e. temporally ordered sequences of links by which nodes can influence each other over time. Our architecture builds on multiple layers of higher-order De Bruijn graphs, an iterative line graph construction where nodes in a De Bruijn graph of order k represent walks of length k-1, while edges represent walks of length k. We develop a graph neural network architecture that utilizes De Bruijn graphs to implement a message passing scheme that follows a non-Markovian dynamics, which enables us to learn patterns in the causal topology of a dynamic graph. Addressing the issue that De Bruijn graphs with different orders k can be used to model the same data set, we further apply statistical model selection to determine the optimal graph topology to be used for message passing. An evaluation in synthetic and empirical data sets suggests that DBGNNs can leverage temporal patterns in dynamic graphs, which substantially improves the performance in a supervised node classification task.  ( 2 min )

Transductive Few-Shot learning has gained increased attention nowadays considering the cost of data annotations along with the increased accuracy provided by unlabelled samples in the domain of few shot. Especially in Few-Shot Classification (FSC), recent works explore the feature distributions aiming at maximizing likelihoods or posteriors with respect to the unknown parameters. Following this vein, and considering the parallel between FSC and clustering, we seek for better taking into account the uncertainty in estimation due to lack of data, as well as better statistical properties of the clusters associated with each class. Therefore in this paper we propose a new clustering method based on Variational Bayesian inference, further improved by Adaptive Dimension Reduction based on Probabilistic Linear Discriminant Analysis. Our proposed method significantly improves accuracy in the realistic unbalanced transductive setting on various Few-Shot benchmarks when applied to features used in previous studies, with a gain of up to $6\%$ in accuracy. In addition, when applied to balanced setting, we obtain very competitive results without making use of the class-balance artefact which is disputable for practical use cases. We also provide the performance of our method on a high performing pretrained backbone, with the reported results further surpassing the current state-of-the-art accuracy, suggesting the genericity of the proposed method.  ( 2 min )

Commercial ML APIs offered by providers such as Google, Amazon and Microsoft have dramatically simplified ML adoption in many applications. Numerous companies and academics pay to use ML APIs for tasks such as object detection, OCR and sentiment analysis. Different ML APIs tackling the same task can have very heterogeneous performance. Moreover, the ML models underlying the APIs also evolve over time. As ML APIs rapidly become a valuable marketplace and a widespread way to consume machine learning, it is critical to systematically study and compare different APIs with each other and to characterize how APIs change over time. However, this topic is currently underexplored due to the lack of data. In this paper, we present HAPI (History of APIs), a longitudinal dataset of 1,761,417 instances of commercial ML API applications (involving APIs from Amazon, Google, IBM, Microsoft and other providers) across diverse tasks including image tagging, speech recognition and text mining from 2020 to 2022. Each instance consists of a query input for an API (e.g., an image or text) along with the API's output prediction/annotation and confidence scores. HAPI is the first large-scale dataset of ML API usages and is a unique resource for studying ML-as-a-service (MLaaS). As examples of the types of analyses that HAPI enables, we show that ML APIs' performance change substantially over time--several APIs' accuracies dropped on specific benchmark datasets. Even when the API's aggregate performance stays steady, its error modes can shift across different subtypes of data between 2020 and 2022. Such changes can substantially impact the entire analytics pipelines that use some ML API as a component. We further use HAPI to study commercial APIs' performance disparities across demographic subgroups over time. HAPI can stimulate more research in the growing field of MLaaS.  ( 3 min )

We address the problem of online sequential decision making, i.e., balancing the trade-off between exploiting the current knowledge to maximize immediate performance and exploring the new information to gain long-term benefits using the multi-armed bandit framework. Thompson sampling is one of the heuristics for choosing actions that address this exploration-exploitation dilemma. We first propose a general framework that helps heuristically tune the exploration versus exploitation trade-off in Thompson sampling using multiple samples from the posterior distribution. Utilizing this framework, we propose two algorithms for the multi-armed bandit problem and provide theoretical bounds on the cumulative regret. Next, we demonstrate the empirical improvement in the cumulative regret performance of the proposed algorithm over Thompson Sampling. We also show the effectiveness of the proposed algorithm on real-world datasets. Contrary to the existing methods, our framework provides a mechanism to vary the amount of exploration/ exploitation based on the task at hand. Towards this end, we extend our framework for two additional problems, i.e., best arm identification and time-sensitive learning in bandits and compare our algorithm with existing methods.  ( 2 min )

This paper is aiming to apply neural network algorithm for predicting the process response (NOx emissions) from degrading natural gas turbines. Nine different process variables, or predictors, are considered in the predictive modelling. It is found out that the model trained by neural network algorithm should use part of recent data in the training and validation sets accounting for the impact of the system degradation. R-Square values of the training and validation sets demonstrate the validity of the model. The residue plot, without any clear pattern, shows the model is appropriate. The ranking of the importance of the process variables are demonstrated and the prediction profile confirms the significance of the process variables. The model trained by using neural network algorithm manifests the optimal settings of the process variables to reach the minimum value of NOx emissions from the degrading gas turbine system.

We develop a modified online mirror descent framework that is suitable for building adaptive and parameter-free algorithms in unbounded domains. We leverage this technique to develop the first unconstrained online linear optimization algorithm achieving an optimal dynamic regret bound, and we further demonstrate that natural strategies based on Follow-the-Regularized-Leader are unable to achieve similar results. We also apply our mirror descent framework to build new parameter-free implicit updates, as well as a simplified and improved unconstrained scale-free algorithm.

Best subset of groups selection (BSGS) is the process of selecting a small part of non-overlapping groups to achieve the best interpretability on the response variable. It has attracted increasing attention and has far-reaching applications in practice. However, due to the computational intractability of BSGS in high-dimensional settings, developing efficient algorithms for solving BSGS remains a research hotspot. In this paper,we propose a group-splicing algorithm that iteratively detects the relevant groups and excludes the irrelevant ones. Moreover, coupled with a novel group information criterion, we develop an adaptive algorithm to determine the optimal model size. Under mild conditions, it is certifiable that our algorithm can identify the optimal subset of groups in polynomial time with high probability. Finally, we demonstrate the efficiency and accuracy of our methods by comparing them with several state-of-the-art algorithms on both synthetic and real-world datasets.

Off-policy Evaluation (OPE) methods are crucial tools for evaluating policies in high-stakes domains such as healthcare, where direct deployment is often infeasible, unethical, or expensive. When deployment environments are expected to undergo changes (that is, dataset shifts), it is important for OPE methods to perform robust evaluation of the policies amidst such changes. Existing approaches consider robustness against a large class of shifts that can arbitrarily change any observable property of the environment. This often results in highly pessimistic estimates of the utilities, thereby invalidating policies that might have been useful in deployment. In this work, we address the aforementioned problem by investigating how domain knowledge can help provide more realistic estimates of the utilities of policies. We leverage human inputs on which aspects of the environments may plausibly change, and adapt the OPE methods to only consider shifts on these aspects. Specifically, we propose a novel framework, Robust OPE (ROPE), which considers shifts on a subset of covariates in the data based on user inputs, and estimates worst-case utility under these shifts. We then develop computationally efficient algorithms for OPE that are robust to the aforementioned shifts for contextual bandits and Markov decision processes. We also theoretically analyze the sample complexity of these algorithms. Extensive experimentation with synthetic and real world datasets from the healthcare domain demonstrates that our approach not only captures realistic dataset shifts accurately, but also results in less pessimistic policy evaluations.

Parameter learning for high-dimensional, partially observed, and nonlinear stochastic processes is a methodological challenge. Spatiotemporal disease transmission systems provide examples of such processes giving rise to open inference problems. We propose the iterated block particle filter (IBPF) algorithm for learning high-dimensional parameters over graphical state space models with general state spaces, measures, transition densities and graph structure. Theoretical performance guarantees are obtained on beating the curse of dimensionality (COD), algorithm convergence, and likelihood maximization. Experiments on a highly nonlinear and non-Gaussian spatiotemporal model for measles transmission reveal that the iterated ensemble Kalman filter algorithm (Li et al. (2020)) is ineffective and the iterated filtering algorithm (Ionides et al. (2015)) suffers from the COD, while our IBPF algorithm beats COD consistently across various experiments with different metrics.

Although overparameterized models have shown their success on many machine learning tasks, the accuracy could drop on the testing distribution that is different from the training one. This accuracy drop still limits applying machine learning in the wild. At the same time, importance weighting, a traditional technique to handle distribution shifts, has been demonstrated to have less or even no effect on overparameterized models both empirically and theoretically. In this paper, we propose importance tempering to improve the decision boundary and achieve consistently better results for overparameterized models. Theoretically, we justify that the selection of group temperature can be different under label shift and spurious correlation setting. At the same time, we also prove that properly selected temperatures can extricate the minority collapse for imbalanced classification. Empirically, we achieve state-of-the-art results on worst group classification tasks using importance tempering.

We introduce a neural stack architecture, including a differentiable parametrized stack operator that approximates stack push and pop operations for suitable choices of parameters that explicitly represents a stack. We prove the stability of this stack architecture: after arbitrarily many stack operations, the state of the neural stack still closely resembles the state of the discrete stack. Using the neural stack with a recurrent neural network, we introduce a neural network Pushdown Automaton (nnPDA) and prove that nnPDA with finite/bounded neurons and time can simulate any PDA. Furthermore, we extend our construction and propose new architecture neural state Turing Machine (nnTM). We prove that differentiable nnTM with bounded neurons can simulate Turing Machine (TM) in real-time. Just like the neural stack, these architectures are also stable. Finally, we extend our construction to show that differentiable nnTM is equivalent to Universal Turing Machine (UTM) and can simulate any TM with only \textbf{seven finite/bounded precision} neurons. This work provides a new theoretical bound for the computational capability of bounded precision RNNs augmented with memory.

With model trustworthiness being crucial for sensitive real-world applications, practitioners are putting more and more focus on improving the uncertainty calibration of deep neural networks. Calibration errors are designed to quantify the reliability of probabilistic predictions but their estimators are usually biased and inconsistent. In this work, we introduce the framework of proper calibration errors, which relates every calibration error to a proper score and provides a respective upper bound with optimal estimation properties. This relationship can be used to reliably quantify the model calibration improvement. We theoretically and empirically demonstrate the shortcomings of commonly used estimators compared to our approach. Due to the wide applicability of proper scores, this gives a natural extension of recalibration beyond classification.  ( 2 min )

We introduce a simple and intuitive framework that provides quantitative explanations of statistical models through the probabilistic assessment of input feature importance. The core idea comes from utilizing the Dirichlet distribution to define the importance of input features and learning it via approximate Bayesian inference. The learned importance has probabilistic interpretation and provides the relative significance of each input feature to a model's output, additionally assessing confidence about its importance quantification. As a consequence of using the Dirichlet distribution over the explanations, we can define a closed-form divergence to gauge the similarity between learned importance under different models. We use this divergence to study the feature importance explainability tradeoffs with essential notions in modern machine learning, such as privacy and fairness. Furthermore, BIF can work on two levels: global explanation (feature importance across all data instances) and local explanation (individual feature importance for each data instance). We show the effectiveness of our method on a variety of synthetic and real datasets, taking into account both tabular and image datasets. The code is available at https://github.com/kamadforge/featimp_dp.  ( 2 min )

The problem of inferring the direct causal parents of a response variable among a large set of explanatory variables is of high practical importance in many disciplines. However, established approaches often scale at least exponentially with the number of explanatory variables, are difficult to extend to nonlinear relationships, and are difficult to extend to cyclic data. Inspired by {\em Debiased} machine learning methods, we study a one-vs.-the-rest feature selection approach to discover the direct causal parent of the response. We propose an algorithm that works for purely observational data while also offering theoretical guarantees, including the case of partially nonlinear relationships possibly under the presence of cycles. As it requires only one estimation for each variable, our approach is applicable even to large graphs. We demonstrate significant improvements compared to established approaches.  ( 2 min )

Federated learning, where algorithms are trained across multiple decentralized devices without sharing local data, is increasingly popular in distributed machine learning practice. Typically, a graph structure $G$ exists behind local devices for communication. In this work, we consider parameter estimation in federated learning with data distribution and communication heterogeneity, as well as limited computational capacity of local devices. We encode the distribution heterogeneity by parametrizing distributions on local devices with a set of distinct $p$-dimensional vectors. We then propose to jointly estimate parameters of all devices under the $M$-estimation framework with the fused Lasso regularization, encouraging an equal estimate of parameters on connected devices in $G$. We provide a general result for our estimator depending on $G$, which can be further calibrated to obtain convergence rates for various specific problem setups. Surprisingly, our estimator attains the optimal rate under certain graph fidelity condition on $G$, as if we could aggregate all samples sharing the same distribution. If the graph fidelity condition is not met, we propose an edge selection procedure via multiple testing to ensure the optimality. To ease the burden of local computation, a decentralized stochastic version of ADMM is provided, with convergence rate $O(T^{-1}\log T)$ where $T$ denotes the number of iterations. We highlight that, our algorithm transmits only parameters along edges of $G$ at each iteration, without requiring a central machine, which preserves privacy. We further extend it to the case where devices are randomly inaccessible during the training process, with a similar algorithmic convergence guarantee. The computational and statistical efficiency of our method is evidenced by simulation experiments and the 2020 US presidential election data set.  ( 3 min )

Most knowledge graphs (KGs) are incomplete, which motivates one important research topic on automatically complementing knowledge graphs. However, evaluation of knowledge graph completion (KGC) models often ignores the incompleteness -- facts in the test set are ranked against all unknown triplets which may contain a large number of missing facts not included in the KG yet. Treating all unknown triplets as false is called the closed-world assumption. This closed-world assumption might negatively affect the fairness and consistency of the evaluation metrics. In this paper, we study KGC evaluation under a more realistic setting, namely the open-world assumption, where unknown triplets are considered to include many missing facts not included in the training or test sets. For the currently most used metrics such as mean reciprocal rank (MRR) and Hits@K, we point out that their behavior may be unexpected under the open-world assumption. Specifically, with not many missing facts, their numbers show a logarithmic trend with respect to the true strength of the model, and thus, the metric increase could be insignificant in terms of reflecting the true model improvement. Further, considering the variance, we show that the degradation in the reported numbers may result in incorrect comparisons between different models, where stronger models may have lower metric numbers. We validate the phenomenon both theoretically and experimentally. Finally, we suggest possible causes and solutions for this problem. Our code and data are available at https://github.com/GraphPKU/Open-World-KG .  ( 3 min )

We consider regret minimization for Adversarial Markov Decision Processes (AMDPs), where the loss functions are changing over time and adversarially chosen, and the learner only observes the losses for the visited state-action pairs (i.e., bandit feedback). While there has been a surge of studies on this problem using Online-Mirror-Descent (OMD) methods, very little is known about the Follow-the-Perturbed-Leader (FTPL) methods, which are usually computationally more efficient and also easier to implement since it only requires solving an offline planning problem. Motivated by this, we take a closer look at FTPL for learning AMDPs, starting from the standard episodic finite-horizon setting. We find some unique and intriguing difficulties in the analysis and propose a workaround to eventually show that FTPL is also able to achieve near-optimal regret bounds in this case. More importantly, we then find two significant applications: First, the analysis of FTPL turns out to be readily generalizable to delayed bandit feedback with order-optimal regret, while OMD methods exhibit extra difficulties (Jin et al., 2022). Second, using FTPL, we also develop the first no-regret algorithm for learning communicating AMDPs in the infinite-horizon setting with bandit feedback and stochastic transitions. Our algorithm is efficient assuming access to an offline planning oracle, while even for the easier full-information setting, the only existing algorithm (Chandrasekaran and Tewari, 2021) is computationally inefficient.  ( 3 min )

The CP decomposition for high dimensional non-orthogonal spiked tensors is an important problem with broad applications across many disciplines. However, previous works with theoretical guarantee typically assume restrictive incoherence conditions on the basis vectors for the CP components. In this paper, we propose new computationally efficient composite PCA and concurrent orthogonalization algorithms for tensor CP decomposition with theoretical guarantees under mild incoherence conditions. The composite PCA applies the principal component or singular value decompositions twice, first to a matrix unfolding of the tensor data to obtain singular vectors and then to the matrix folding of the singular vectors obtained in the first step. It can be used as an initialization for any iterative optimization schemes for the tensor CP decomposition. The concurrent orthogonalization algorithm iteratively estimates the basis vector in each mode of the tensor by simultaneously applying projections to the orthogonal complements of the spaces generated by other CP components in other modes. It is designed to improve the alternating least squares estimator and other forms of the high order orthogonal iteration for tensors with low or moderately high CP ranks, and it is guaranteed to converge rapidly when the error of any given initial estimator is bounded by a small constant. Our theoretical investigation provides estimation accuracy and convergence rates for the two proposed algorithms. Both proposed algorithms are applicable to deterministic tensor, its noisy version, and the order-$2K$ covariance tensor of order-$K$ tensor data in a factor model with uncorrelated factors. Our implementations on synthetic data demonstrate significant practical superiority of our approach over existing methods.  ( 3 min )

We design fast algorithms for repeatedly sampling from strongly Rayleigh distributions, which include random spanning tree distributions and determinantal point processes. For a graph $G=(V, E)$, we show how to approximately sample uniformly random spanning trees from $G$ in $\widetilde{O}(\lvert V\rvert)$ time per sample after an initial $\widetilde{O}(\lvert E\rvert)$ time preprocessing. For a determinantal point process on subsets of size $k$ of a ground set of $n$ elements, we show how to approximately sample in $\widetilde{O}(k^\omega)$ time after an initial $\widetilde{O}(nk^{\omega-1})$ time preprocessing, where $\omega<2.372864$ is the matrix multiplication exponent. We even improve the state of the art for obtaining a single sample from determinantal point processes, from the prior runtime of $\widetilde{O}(\min\{nk^2, n^\omega\})$ to $\widetilde{O}(nk^{\omega-1})$. In our main technical result, we achieve the optimal limit on domain sparsification for strongly Rayleigh distributions. In domain sparsification, sampling from a distribution $\mu$ on $\binom{[n]}{k}$ is reduced to sampling from related distributions on $\binom{[t]}{k}$ for $t\ll n$. We show that for strongly Rayleigh distributions, we can can achieve the optimal $t=\widetilde{O}(k)$. Our reduction involves sampling from $\widetilde{O}(1)$ domain-sparsified distributions, all of which can be produced efficiently assuming convenient access to approximate overestimates for marginals of $\mu$. Having access to marginals is analogous to having access to the mean and covariance of a continuous distribution, or knowing "isotropy" for the distribution, the key assumption behind the Kannan-Lov\'asz-Simonovits (KLS) conjecture and optimal samplers based on it. We view our result as a moral analog of the KLS conjecture and its consequences for sampling, for discrete strongly Rayleigh measures.  ( 3 min )

Homomorphic sensing is a recent algebraic-geometric framework that studies the unique recovery of points in a linear subspace from their images under a given collection of linear maps. It has been successful in interpreting such a recovery in the case of permutations composed by coordinate projections, an important instance in applications known as unlabeled sensing, which models data that are out of order and have missing values. In this paper, we provide tighter and simpler conditions that guarantee the unique recovery for the single-subspace case, extend the result to the case of a subspace arrangement, and show that the unique recovery in a single subspace is locally stable under noise. We specialize our results to several examples of homomorphic sensing such as real phase retrieval and unlabeled sensing. In so doing, in a unified way, we obtain conditions that guarantee the unique recovery for those examples, typically known via diverse techniques in the literature, as well as novel conditions for sparse and unsigned versions of unlabeled sensing. Similarly, our noise result also implies that the unique recovery in unlabeled sensing is locally stable.  ( 3 min )

An effective weighting scheme for training samples is essential for learning tasks. Numerous weighting schemes have been proposed. Some schemes take the easy-first mode, whereas some others take the hard-first one. Naturally, an interesting yet realistic question is raised. Which samples should be learned first given a new learning task, easy or hard? To answer this question, both theoretical analyses and experimental verification are conducted. First, a general optimized objective function is proposed, revealing the relationship between the difficulty distribution and the difficulty-based sample weights. Second, on the basis of the optimized objective function, theoretical answers are obtained. Besides the easy-first and hard-first modes, there are two other priority modes, namely, medium-first and two-ends-first. The prior mode does not necessarily remain unchanged during the training process. Third, an effective and universal solution is proposed to select the optimal priority mode when there is no prior knowledge or theoretical clues. The four modes, namely, easy/medium/hard/two-ends-first, can be flexibly switched in the proposed solution. Fourth, a wide range of experiments is conducted under various scenarios to further compare the weighting schemes in different modes. On the basis of these works, reasonable and comprehensive answers are obtained. Factors including the distribution of samples' learning difficulties and the validation data determine which samples should be learned first in a learning task.  ( 3 min )

Principal Component Analysis (PCA) minimizes the reconstruction error given a class of linear models of fixed component dimensionality. Probabilistic PCA adds a probabilistic structure by learning the probability distribution of the PCA latent space weights, thus creating a generative model. Autoencoders (AE) minimize the reconstruction error in a class of nonlinear models of fixed latent space dimensionality and outperform PCA at fixed dimensionality. Here, we introduce the Probabilistic Autoencoder (PAE) that learns the probability distribution of the AE latent space weights using a normalizing flow (NF). The PAE is fast and easy to train and achieves small reconstruction errors, high sample quality, and good performance in downstream tasks. We compare the PAE to Variational AE (VAE), showing that the PAE trains faster, reaches a lower reconstruction error, and produces good sample quality without requiring special tuning parameters or training procedures. We further demonstrate that the PAE is a powerful model for performing the downstream tasks of probabilistic image reconstruction in the context of Bayesian inference of inverse problems for inpainting and denoising applications. Finally, we identify latent space density from NF as a promising outlier detection metric.

The staple of human intelligence is the capability of acquiring knowledge in a continuous fashion. In stark contrast, Deep Networks forget catastrophically and, for this reason, the sub-field of Class-Incremental Continual Learning fosters methods that learn a sequence of tasks incrementally, blending sequentially-gained knowledge into a comprehensive prediction. This work aims at assessing and overcoming the pitfalls of our previous proposal Dark Experience Replay (DER), a simple and effective approach that combines rehearsal and Knowledge Distillation. Inspired by the way our minds constantly rewrite past recollections and set expectations for the future, we endow our model with the abilities to i) revise its replay memory to welcome novel information regarding past data ii) pave the way for learning yet unseen classes. We show that the application of these strategies leads to remarkable improvements; indeed, the resulting method - termed eXtended-DER (X-DER) - outperforms the state of the art on both standard benchmarks (such as CIFAR-100 and miniImagenet) and a novel one here introduced. To gain a better understanding, we further provide extensive ablation studies that corroborate and extend the findings of our previous research (e.g. the value of Knowledge Distillation and flatter minima in continual learning setups).

The autism dataset is studied to identify the differences between autistic and healthy groups. For this, the resting-state Functional Magnetic Resonance Imaging (rs-fMRI) data of the two groups are analyzed, and networks of connections between brain regions were created. Several classification frameworks are developed to distinguish the connectivity patterns between the groups. The best models for statistical inference and precision were compared, and the tradeoff between precision and model interpretability was analyzed. Finally, the classification accuracy measures were reported to justify the performance of our framework. Our best model can classify autistic and healthy patients on the multisite ABIDE I data with 71% accuracy.

When training overparameterized deep networks for classification tasks, it has been widely observed that the learned features exhibit a so-called "neural collapse" phenomenon. More specifically, for the output features of the penultimate layer, for each class the within-class features converge to their means, and the means of different classes exhibit a certain tight frame structure, which is also aligned with the last layer's classifier. As feature normalization in the last layer becomes a common practice in modern representation learning, in this work we theoretically justify the neural collapse phenomenon for normalized features. Based on an unconstrained feature model, we simplify the empirical loss function in a multi-class classification task into a nonconvex optimization problem over the Riemannian manifold by constraining all features and classifiers over the sphere. In this context, we analyze the nonconvex landscape of the Riemannian optimization problem over the product of spheres, showing a benign global landscape in the sense that the only global minimizers are the neural collapse solutions while all other critical points are strict saddles with negative curvature. Experimental results on practical deep networks corroborate our theory and demonstrate that better representations can be learned faster via feature normalization.

We study the convergence properties, in Hellinger and related distances, of nonparametric density estimators based on measure transport. These estimators represent the measure of interest as the pushforward of a chosen reference distribution under a transport map, where the map is chosen via a maximum likelihood objective (equivalently, minimizing an empirical Kullback-Leibler loss) or a penalized version thereof. We establish concentration inequalities for a general class of penalized measure transport estimators, by combining techniques from M-estimation with analytical properties of the transport-based density representation. We then demonstrate the implications of our theory for the case of triangular Knothe-Rosenblatt (KR) transports on the $d$-dimensional unit cube, and show that both penalized and unpenalized versions of such estimators achieve minimax optimal convergence rates over H\"older classes of densities. Specifically, we establish optimal rates for unpenalized nonparametric maximum likelihood estimation over bounded H\"older-type balls, and then for certain Sobolev-penalized estimators and sieved wavelet estimators.

Node clustering is a powerful tool in the analysis of networks. We introduce a graph neural network framework to obtain node embeddings for directed networks in a self-supervised manner, including a novel probabilistic imbalance loss, which can be used for network clustering. Here, we propose directed flow imbalance measures, which are tightly related to directionality, to reveal clusters in the network even when there is no density difference between clusters. In contrast to standard approaches in the literature, in this paper, directionality is not treated as a nuisance, but rather contains the main signal. DIGRAC optimizes directed flow imbalance for clustering without requiring label supervision, unlike existing graph neural network methods, and can naturally incorporate node features, unlike existing spectral methods. Extensive experimental results on synthetic data, in the form of directed stochastic block models, and real-world data at different scales, demonstrate that our method, based on flow imbalance, attains state-of-the-art results on directed graph clustering when compared against 10 state-of-the-art methods from the literature, for a wide range of noise and sparsity levels, graph structures and topologies, and even outperforms supervised methods.

This paper presents the HiPart package, an open-source native python library that provides efficient and interpret-able implementations of divisive hierarchical clustering algorithms. HiPart supports interactive visualizations for the manipulation of the execution steps allowing the direct intervention of the clustering outcome. This package is highly suited for Big Data applications as the focus has been given to the computational efficiency of the implemented clustering methodologies. The dependencies used are either Python build-in packages or highly maintained stable external packages. The software is provided under the MIT license. The package's source code and documentation can be found at https://github.com/panagiotisanagnostou/HiPart.

The concept of causality plays an important role in human cognition . In the past few decades, causal inference has been well developed in many fields, such as computer science, medicine, economics, and education. With the advancement of deep learning techniques, it has been increasingly used in causal inference against counterfactual data. Typically, deep causal models map the characteristics of covariates to a representation space and then design various objective optimization functions to estimate counterfactual data unbiasedly based on the different optimization methods. This paper focuses on the survey of the deep causal models, and its core contributions are as follows: 1) we provide relevant metrics under multiple treatments and continuous-dose treatment; 2) we incorporate a comprehensive overview of deep causal models from both temporal development and method classification perspectives; 3) we assist a detailed and comprehensive classification and analysis of relevant datasets and source code.

Subgraph isomorphism or subgraph matching is generally considered as an NP-complete problem, made more complex in practical applications where the edge weights take real values and are subject to measurement noise and possible anomalies. To the best of our knowledge, almost all subgraph matching methods utilize node labels to perform node-node matching. In the absence of such labels (in applications such as image matching and map matching among others), these subgraph matching methods do not work. We propose a method for identifying the node correspondence between a subgraph and a full graph in the inexact case without node labels in two steps - (a) extract the minimal unique topology preserving subset from the subgraph and find its feasible matching in the full graph, and (b) implement a consensus-based algorithm to expand the matched node set by pairing unique paths based on boundary commutativity. Going beyond the existing subgraph matching approaches, the proposed method is shown to have realistically sub-linear computational efficiency, robustness to random measurement noise, and good statistical properties. Our method is also readily applicable to the exact matching case without loss of generality. To demonstrate the effectiveness of the proposed method, a simulation and a case study is performed on the Erdos-Renyi random graphs and the image-based affine covariant features dataset respectively.

Causal discovery for quantitative data has been extensively studied but less is known for categorical data. We propose a novel causal model for categorical data based on a new classification model, termed classification with optimal label permutation (COLP). By design, COLP is a parsimonious classifier, which gives rise to a provably identifiable causal model. A simple learning algorithm via comparing likelihood functions of causal and anti-causal models suffices to learn the causal direction. Through experiments with synthetic and real data, we demonstrate the favorable performance of the proposed COLP-based causal model compared to state-of-the-art methods. We also make available an accompanying R package COLP, which contains the proposed causal discovery algorithm and a benchmark dataset of categorical cause-effect pairs.

The computational prediction of wave propagation in dam-break floods is a long-standing problem in hydrodynamics and hydrology. Until now, conventional numerical models based on Saint-Venant equations are the dominant approaches. Here we show that a machine learning model that is well-trained on a minimal amount of data, can help predict the long-term dynamic behavior of a one-dimensional dam-break flood with satisfactory accuracy. For this purpose, we solve the Saint-Venant equations for a one-dimensional dam-break flood scenario using the Lax-Wendroff numerical scheme and train the reservoir computing echo state network (RC-ESN) with the dataset by the simulation results consisting of time-sequence flow depths. We demonstrate a good prediction ability of the RC-ESN model, which ahead predicts wave propagation behavior 286 time-steps in the dam-break flood with a root mean square error (RMSE) smaller than 0.01, outperforming the conventional long short-term memory (LSTM) model which reaches a comparable RMSE of only 81 time-steps ahead. To show the performance of the RC-ESN model, we also provide a sensitivity analysis of the prediction accuracy concerning the key parameters including training set size, reservoir size, and spectral radius. Results indicate that the RC-ESN are less dependent on the training set size, a medium reservoir size K=1200~2600 is sufficient. We confirm that the spectral radius \r{ho} shows a complex influence on the prediction accuracy and suggest a smaller spectral radius \r{ho} currently. By changing the initial flow depth of the dam break, we also obtained the conclusion that the prediction horizon of RC-ESN is larger than that of LSTM.

The minimum sum-of-squares clustering (MSSC), or k-means type clustering, has been recently extended to exploit prior knowledge on the cardinality of each cluster. Such knowledge is used to increase performance as well as solution quality. In this paper, we propose an exact approach based on the branch-and-cut technique to solve the cardinality-constrained MSSC. For the lower bound routine, we use the semidefinite programming (SDP) relaxation recently proposed by Rujeerapaiboon et al. [SIAM J. Optim. 29(2), 1211-1239, (2019)]. However, this relaxation can be used in a branch-and-cut method only for small-size instances. Therefore, we derive a new SDP relaxation that scales better with the instance size and the number of clusters. In both cases, we strengthen the bound by adding polyhedral cuts. Benefiting from a tailored branching strategy which enforces pairwise constraints, we reduce the complexity of the problems arising in the children nodes. For the upper bound, instead, we present a local search procedure that exploits the solution of the SDP relaxation solved at each node. Computational results show that the proposed algorithm globally solves, for the first time, real-world instances of size 10 times larger than those solved by state-of-the-art exact methods.

\cite{rohe2016co} proposed Stochastic co-Blockmodel (ScBM) as a tool for detecting community structure of binary directed graph data in network studies. However, ScBM completely ignores node weight, and is unable to explain the block structure of directed weighted network which appears in various areas, such as biology, sociology, physiology and computer science. Here, to model directed weighted network, we introduce a Directed Distribution-Free model by releasing ScBM's distribution restriction. We also build an extension of the proposed model by considering variation of node degree. Our models do not require a specific distribution on generating elements of adjacency matrix but only a block structure on the expected adjacency matrix. Spectral algorithms with theoretical guarantee on consistent estimation of node label are presented to identify communities. Our proposed methods are illustrated by simulated and empirical examples.  ( 2 min )

Machine unlearning is a process of removing the impact of some training data from the machine learning (ML) models upon receiving removal requests. While straightforward and legitimate, retraining the ML model from scratch incurs a high computational overhead. To address this issue, a number of approximate algorithms have been proposed in the domain of image and text data, among which SISA is the state-of-the-art solution. It randomly partitions the training set into multiple shards and trains a constituent model for each shard. However, directly applying SISA to the graph data can severely damage the graph structural information, and thereby the resulting ML model utility. In this paper, we propose GraphEraser, a novel machine unlearning framework tailored to graph data. Its contributions include two novel graph partition algorithms and a learning-based aggregation method. We conduct extensive experiments on five real-world graph datasets to illustrate the unlearning efficiency and model utility of GraphEraser. It achieves 2.06$\times$ (small dataset) to 35.94$\times$ (large dataset) unlearning time improvement. On the other hand, GraphEraser achieves up to $62.5\%$ higher F1 score and our proposed learning-based aggregation method achieves up to $112\%$ higher F1 score.\footnote{Our code is available at \url{https://github.com/MinChen00/Graph-Unlearning}.}  ( 3 min )

In the pursuit of explaining implicit regularization in deep learning, prominent focus was given to matrix and tensor factorizations, which correspond to simplified neural networks. It was shown that these models exhibit an implicit tendency towards low matrix and tensor ranks, respectively. Drawing closer to practical deep learning, the current paper theoretically analyzes the implicit regularization in hierarchical tensor factorization, a model equivalent to certain deep convolutional neural networks. Through a dynamical systems lens, we overcome challenges associated with hierarchy, and establish implicit regularization towards low hierarchical tensor rank. This translates to an implicit regularization towards locality for the associated convolutional networks. Inspired by our theory, we design explicit regularization discouraging locality, and demonstrate its ability to improve the performance of modern convolutional networks on non-local tasks, in defiance of conventional wisdom by which architectural changes are needed. Our work highlights the potential of enhancing neural networks via theoretical analysis of their implicit regularization.  ( 3 min )

Networks are ubiquitous in many real-world applications (e.g., social networks encoding trust/distrust relationships, correlation networks arising from time series data). While many networks are signed or directed, or both, there is a lack of unified software packages on graph neural networks (GNNs) specially designed for signed and directed networks. In this paper, we present PyTorch Geometric Signed Directed, a software package which fills this gap. Along the way, we also provide a brief review surveying typical tasks, loss functions and evaluation metrics in the analysis of signed and directed networks, discuss data used in related experiments, provide an overview of methods proposed, and evaluate the implemented methods with experiments. The deep learning framework consists of easy-to-use GNN models, synthetic and real-world data, as well as task-specific evaluation metrics and loss functions for signed and directed networks. As an extension library for PyTorch Geometric, our proposed software is maintained with open-source releases, detailed documentation, continuous integration, unit tests and code coverage checks. Our code is publicly available at \url{https://github.com/SherylHYX/pytorch_geometric_signed_directed}.  ( 3 min )

Mixtures of experts (MoE) models are a popular framework for modeling heterogeneity in data, for both regression and classification problems in statistics and machine learning, due to their flexibility and the abundance of available statistical estimation and model choice tools. Such flexibility comes from allowing the mixture weights (or gating functions) in the MoE model to depend on the explanatory variables, along with the experts (or component densities). This permits the modeling of data arising from more complex data generating processes when compared to the classical finite mixtures and finite mixtures of regression models, whose mixing parameters are independent of the covariates. The use of MoE models in a high-dimensional setting, when the number of explanatory variables can be much larger than the sample size, is challenging from a computational point of view, and in particular from a theoretical point of view, where the literature is still lacking results for dealing with the curse of dimensionality, for both the statistical estimation and feature selection problems. We consider the finite MoE model with soft-max gating functions and Gaussian experts for high-dimensional regression on heterogeneous data, and its $l_1$-regularized estimation via the Lasso. We focus on the Lasso estimation properties rather than its feature selection properties. We provide a lower bound on the regularization parameter of the Lasso function that ensures an $l_1$-oracle inequality satisfied by the Lasso estimator according to the Kullback--Leibler loss.

Purpose: We perform anatomical landmarking for craniomaxillofacial (CMF) bones without explicitly segmenting them. Towards this, we propose a new simple yet efficient deep network architecture, called \textit{relational reasoning network (RRN)}, to accurately learn the local and the global relations among the landmarks in CMF bones; specifically, mandible, maxilla, and nasal bones. Approach: The proposed RRN works in an end-to-end manner, utilizing learned relations of the landmarks based on dense-block units. For a given few landmarks as input, RRN treats the landmarking process similar to a data imputation problem where predicted landmarks are considered missing. Results: We applied RRN to cone beam computed tomography scans obtained from 250 patients. With a 4-fold cross validation technique, we obtained an average root mean squared error of less than 2 mm per landmark. Our proposed RRN has revealed unique relationships among the landmarks that help us in inferring several \textit{reasoning} about informativeness of the landmark points. The proposed system identifies the missing landmark locations accurately even when severe pathology or deformation are present in the bones. Conclusions: Accurately identifying anatomical landmarks is a crucial step in deformation analysis and surgical planning for CMF surgeries. Achieving this goal without the need for explicit bone segmentation addresses a major limitation of segmentation based approaches, where segmentation failure (as often the case in bones with severe pathology or deformation) could easily lead to incorrect landmarking. To the best of our knowledge, this is the first of its kind algorithm finding anatomical relations of the objects using deep learning.  ( 3 min )

We consider the batch (off-line) policy learning problem in the infinite horizon Markov Decision Process. Motivated by mobile health applications, we focus on learning a policy that maximizes the long-term average reward. We propose a doubly robust estimator for the average reward and show that it achieves semiparametric efficiency. Further we develop an optimization algorithm to compute the optimal policy in a parameterized stochastic policy class. The performance of the estimated policy is measured by the difference between the optimal average reward in the policy class and the average reward of the estimated policy and we establish a finite-sample regret guarantee. The performance of the method is illustrated by simulation studies and an analysis of a mobile health study promoting physical activity.  ( 2 min )

In this paper, we study the statistical limits in terms of Sobolev norms of gradient descent for solving inverse problem from randomly sampled noisy observations using a general class of objective functions. Our class of objective functions includes Sobolev training for kernel regression, Deep Ritz Methods (DRM), and Physics Informed Neural Networks (PINN) for solving elliptic partial differential equations (PDEs) as special cases. We consider a potentially infinite-dimensional parameterization of our model using a suitable Reproducing Kernel Hilbert Space and a continuous parameterization of problem hardness through the definition of kernel integral operators. We prove that gradient descent over this objective function can also achieve statistical optimality and the optimal number of passes over the data increases with sample size. Based on our theory, we explain an implicit acceleration of using a Sobolev norm as the objective function for training, inferring that the optimal number of epochs of DRM becomes larger than the number of PINN when both the data size and the hardness of tasks increase, although both DRM and PINN can achieve statistical optimality.  ( 3 min )

Leave-one-out cross-validation (LOO-CV) is a popular method for estimating out-of-sample predictive accuracy. However, computing LOO-CV criteria can be computationally expensive due to the need to fit the model multiple times. In the Bayesian context, importance sampling provides a possible solution but classical approaches can easily produce estimators whose variance is infinite, making them potentially unreliable. Here we propose and analyze a novel mixture estimator to compute Bayesian LOO-CV criteria. Our method retains the simplicity and computational convenience of classical approaches, while guaranteeing finite variance of the resulting estimators. Both theoretical and numerical results are provided to illustrate the improved robustness and efficiency. The computational benefits are particularly significant in high-dimensional problems, allowing to perform Bayesian LOO-CV for a broader range of models. The proposed methodology is easily implementable in standard probabilistic programming software and has a computational cost roughly equivalent to fitting the original model once.  ( 2 min )

In semiconductor manufacturing, wafer map defect pattern provides critical information for facility maintenance and yield management, so the classification of defect patterns is one of the most important tasks in the manufacturing process. In this paper, we propose a novel way to represent the shape of the defect pattern as a finite-dimensional vector, which will be used as an input for a neural network algorithm for classification. The main idea is to extract the topological features of each pattern by using the theory of persistent homology from topological data analysis (TDA). Through some experiments with a simulated dataset, we show that the proposed method is faster and much more efficient in training with higher accuracy, compared with the method using convolutional neural networks (CNN) which is the most common approach for wafer map defect pattern classification. Moreover, our method outperforms the CNN-based method when the number of training data is not enough and is imbalanced.  ( 2 min )

Federated learning learns a neural network model by aggregating the knowledge from a group of distributed clients under the privacy-preserving constraint. In this work, we show that this paradigm might inherit the adversarial vulnerability of the centralized neural network, i.e., it has deteriorated performance on adversarial examples when the model is deployed. This is even more alarming when federated learning paradigm is designed to approximate the updating behavior of a centralized neural network. To solve this problem, we propose an adversarially robust federated learning framework, named Fed_BVA, with improved server and client update mechanisms. This is motivated by our observation that the generalization error in federated learning can be naturally decomposed into the bias and variance triggered by multiple clients' predictions. Thus, we propose to generate the adversarial examples via maximizing the bias and variance during server update, and learn the adversarially robust model updates with those examples during client update. As a result, an adversarially robust neural network can be aggregated from these improved local clients' model updates. The experiments are conducted on multiple benchmark data sets using several prevalent neural network models, and the empirical results show that our framework is robust against white-box and black-box adversarial corruptions under both IID and non-IID settings.  ( 3 min )

In this paper, we propose a new covering technique localized for the trajectories of SGD. This localization provides an algorithm-specific complexity measured by the covering number, which can have dimension-independent cardinality in contrast to standard uniform covering arguments that result in exponential dimension dependency. Based on this localized construction, we show that if the objective function is a finite perturbation of a piecewise strongly convex and smooth function with $P$ pieces, i.e. non-convex and non-smooth in general, the generalization error can be upper bounded by $O(\sqrt{(\log n\log(nP))/n})$, where $n$ is the number of data samples. In particular, this rate is independent of dimension and does not require early stopping and decaying step size. Finally, we employ these results in various contexts and derive generalization bounds for multi-index linear models, multi-class support vector machines, and $K$-means clustering for both hard and soft label setups, improving the known state-of-the-art rates.  ( 2 min )

This paper studies the fundamental problem of learning energy-based model (EBM) in the latent space of the generator model. Learning such prior model typically requires running costly Markov Chain Monte Carlo (MCMC). Instead, we propose to use noise contrastive estimation (NCE) to discriminatively learn the EBM through density ratio estimation between the latent prior density and latent posterior density. However, the NCE typically fails to accurately estimate such density ratio given large gap between two densities. To effectively tackle this issue and learn more expressive prior models, we develop the adaptive multi-stage density ratio estimation which breaks the estimation into multiple stages and learn different stages of density ratio sequentially and adaptively. The latent prior model can be gradually learned using ratio estimated in previous stage so that the final latent space EBM prior can be naturally formed by product of ratios in different stages. The proposed method enables informative and much sharper prior than existing baselines, and can be trained efficiently. Our experiments demonstrate strong performances in image generation and reconstruction as well as anomaly detection.  ( 2 min )

Two aspects of neural networks that have been extensively studied in the recent literature are their function approximation properties and their training by gradient descent methods. The approximation problem seeks accurate approximations with a minimal number of weights. In most of the current literature these weights are fully or partially hand-crafted, showing the capabilities of neural networks but not necessarily their practical performance. In contrast, optimization theory for neural networks heavily relies on an abundance of weights in over-parametrized regimes. This paper balances these two demands and provides an approximation result for shallow networks in $1d$ with non-convex weight optimization by gradient descent. We consider finite width networks and infinite sample limits, which is the typical setup in approximation theory. Technically, this problem is not over-parametrized, however, some form of redundancy reappears as a loss in approximation rate compared to best possible rates.  ( 2 min )

Deployed machine learning (ML) models often encounter new user data that differs from their training data. Therefore, estimating how well a given model might perform on the new data is an important step toward reliable ML applications. This is very challenging, however, as the data distribution can change in flexible ways, and we may not have any labels on the new data, which is often the case in monitoring settings. In this paper, we propose a new distribution shift model, Sparse Joint Shift (SJS), which considers the joint shift of both labels and a few features. This unifies and generalizes several existing shift models including label shift and sparse covariate shift, where only marginal feature or label distribution shifts are considered. We describe mathematical conditions under which SJS is identifiable. We further propose SEES, an algorithmic framework to characterize the distribution shift under SJS and to estimate a model's performance on new data without any labels. We conduct extensive experiments on several real-world datasets with various ML models. Across different datasets and distribution shifts, SEES achieves significant (up to an order of magnitude) shift estimation error improvements over existing approaches.  ( 2 min )

Deep learning models have shown impressive results in a variety of time series forecasting tasks, where modeling the conditional distribution of the future given the past is the essence. However, when this conditional distribution is non-stationary, it poses challenges for these models to learn consistently and to predict accurately. In this work, we propose a new method to model non-stationary conditional distributions over time by clearly decoupling stationary conditional distribution modeling from non-stationary dynamics modeling. Our method is based on a Bayesian dynamic model that can adapt to conditional distribution changes and a deep conditional distribution model that can handle large multivariate time series using a factorized output space. Our experimental results on synthetic and popular public datasets show that our model can adapt to non-stationary time series better than state-of-the-art deep learning solutions.  ( 2 min )

Capturing the conditional covariances or correlations among the elements of a multivariate response vector based on covariates is important to various fields including neuroscience, epidemiology and biomedicine. We propose a new method called Covariance Regression with Random Forests (CovRegRF) to estimate the covariance matrix of a multivariate response given a set of covariates, using a random forest framework. Random forest trees are built with a splitting rule specially designed to maximize the difference between the sample covariance matrix estimates of the child nodes. We also propose a significance test for the partial effect of a subset of covariates. We evaluate the performance of the proposed method and significance test through a simulation study which shows that the proposed method provides accurate covariance matrix estimates and that the Type-1 error is well controlled. We also demonstrate an application of the proposed method with a thyroid disease data set.  ( 2 min )

As a tool for estimating networks in high dimensions, graphical models are commonly applied to calcium imaging data to estimate functional neuronal connectivity, i.e. relationships between the activities of neurons. However, in many calcium imaging data sets, the full population of neurons is not recorded simultaneously, but instead in partially overlapping blocks. This leads to the Graph Quilting problem, as first introduced by (Vinci et.al. 2019), in which the goal is to infer the structure of the full graph when only subsets of features are jointly observed. In this paper, we study a novel two-step approach to Graph Quilting, which first imputes the complete covariance matrix using low-rank covariance completion techniques before estimating the graph structure. We introduce three approaches to solve this problem: block singular value decomposition, nuclear norm penalization, and non-convex low-rank factorization. While prior works have studied low-rank matrix completion, we address the challenges brought by the block-wise missingness and are the first to investigate the problem in the context of graph learning. We discuss theoretical properties of the two-step procedure, showing graph selection consistency of one proposed approach by proving novel L infinity-norm error bounds for matrix completion with block-missingness. We then investigate the empirical performance of the proposed methods on simulations and on real-world data examples, through which we show the efficacy of these methods for estimating functional connectivity from calcium imaging data.  ( 3 min )

Bayesian variable selection methods are powerful techniques for fitting and inferring on sparse high-dimensional linear regression models. However, many are computationally intensive or require restrictive prior distributions on model parameters. Likelihood based penalization methods are more computationally friendly, but resource intensive refitting techniques are needed for inference. In this paper, we proposed an efficient and powerful Bayesian approach for sparse high-dimensional linear regression. Minimal prior assumptions on the parameters are required through the use of plug-in empirical Bayes estimates of hyperparameters. Efficient maximum a posteriori probability (MAP) estimation is completed through the use of a partitioned and extended expectation conditional maximization (ECM) algorithm. The result is a PaRtitiOned empirical Bayes Ecm (PROBE) algorithm applied to sparse high-dimensional linear regression. We propose methods to estimate credible and prediction intervals for predictions of future values. We compare the empirical properties of predictions and our predictive inference to comparable approaches with numerous simulation studies and an analysis of cancer cell lines drug response study. The proposed approach is implemented in the R package probe.  ( 2 min )

Predictions and forecasts of machine learning models should take the form of probability distributions, aiming to increase the quantity of information communicated to end users. Although applications of probabilistic prediction and forecasting with machine learning models in academia and industry are becoming more frequent, related concepts and methods have not been formalized and structured under a holistic view of the entire field. Here, we review the topic of predictive uncertainty estimation with machine learning algorithms, as well as the related metrics (consistent scoring functions and proper scoring rules) for assessing probabilistic predictions. The review covers a time period spanning from the introduction of early statistical (linear regression and time series models, based on Bayesian statistics or quantile regression) to recent machine learning algorithms (including generalized additive models for location, scale and shape, random forests, boosting and deep learning algorithms) that are more flexible by nature. The review of the progress in the field, expedites our understanding on how to develop new algorithms tailored to users' needs, since the latest advancements are based on some fundamental concepts applied to more complex algorithms. We conclude by classifying the material and discussing challenges that are becoming a hot topic of research.  ( 2 min )

We consider the problem of estimating the topology of multiple networks from nodal observations, where these networks are assumed to be drawn from the same (unknown) random graph model. We adopt a graphon as our random graph model, which is a nonparametric model from which graphs of potentially different sizes can be drawn. The versatility of graphons allows us to tackle the joint inference problem even for the cases where the graphs to be recovered contain different number of nodes and lack precise alignment across the graphs. Our solution is based on combining a maximum likelihood penalty with graphon estimation schemes and can be used to augment existing network inference methods. The proposed joint network and graphon estimation is further enhanced with the introduction of a robust method for noisy graph sampling information. We validate our proposed approach by comparing its performance against competing methods in synthetic and real-world datasets.  ( 2 min )

Data science assists SEO experts in countless ways, like personalizing the customer experience, understanding client requirements, and many other things. The post How to Use Data Science for Search Engine Optimization appeared first on Data Science Central.  ( 20 min )

The quintessential example of a digital twin is the wind turbine. A digital twin is a real-time virtual representation of a real-world physical system or process that serves as its digital counterpart of it. Like all models or abstractions, a twin is created for practical purposes i.e. we wish to model a physical system of a phenomenon to understand it better. The post Digital Twins as Building Blocks of the Metaverse appeared first on Data Science Central.  ( 20 min )

Good evening, everyone. I hope everyone is well. We all know that the IT area as a whole, especially in the area of artificial intelligence, has been having almost daily updates about new methodologies, algorithms, tools, etc. How do you keep yourselves updated? In my case, I subscribe to some newsletters in the data area: Data Engineering Podcast Harvard Data Science Review Made With ML MLOps Newsletter Papers With Code The Batch The Variable Some other newsletters I subscribe to, but which are not directly connected to AI: ByteByteGo Medium NVIDIA submitted by /u/barash-616 [link] [comments]  ( 89 min )

Hello! I wanted to share our recent work on understanding & explaining ML models through natural language conversations. We use dialogues as an accesible tool for model understanding, so anyone can "talk" to an ML model to understand it, like its another colleague. We also provide a flexible implementation you can adapt to your models & datasets. Twitter thread: https://twitter.com/dylanslack20/status/1571945003676737537 Paper: https://arxiv.org/abs/2207.04154 Code: https://github.com/dylan-slack/TalkToModel submitted by /u/dylan-slack [link] [comments]  ( 88 min )

Would we be able to achieve a breakthrough if we make a more robust model even though we do not increase the data set or the parameters of the model or would we have to wait until there's a breakthrough made in hardware so that we can play with models that have 1000 trillion parameters like our brains? Is it the problem of hardware or software? And if it is a problem of hardware, is AI really only reserved for the extremely wealthy organizations who can afford to train such a huge model? Was depressed after realizing that GPT-3 is not opensource and I need to pay a huge amount of $$ to use their API and that it would be impossible for me, a college student, to build and train such a huge model only with a laptop. I just wanna build a small chatbot that can have conversation with me... submitted by /u/After_Philosopher572 [link] [comments]  ( 91 min )

This is somewhat random... But I recently remembered that years back when I did Andrew Ng's Coursera course on machine learning I was watching one of his lectures in a library fully immersed in the technicalities when he suddenly dropped some random statement about "mathematicians" and "love" or something that made him and the audience laugh (and me also in the quiet library). Now I am trying to find that part in the lectures, but couldn't until now and I don't want to rewatch the entire thing. I think it's this playlist: https://www.youtube.com/watch?v=UzxYlbK2c7E&list=PLA89DCFA6ADACE599. Anyone know what I am talking about and maybe can pinpoint it to me? submitted by /u/doktorfaustus91 [link] [comments]  ( 89 min )

Good afternoon everyone. I hope you are all well. My advisor and I are planning a course on Reinforcement Learning to teach in our master's program at our university. This will be the first time we are teaching this course, so we have no previous experiences to use as a basis. Context: It is a professional master's program, so the students are inserted into the labor market. The graduate program has 3 lines of research: IT infrastructure; computational intelligence (AI); software engineering. Usually, the courses have students from all 3 research lines, so the intention would be to teach a course that both gives an overview of the area, and gives directions for the AI students to go deeper. What we have already thought about: For now, we only think in the coding context, we will use the following tools: Python; Numpy; JAX; PyTorch; Jupyter Notebook. With this, we intend to make algorithms from scratch (Numpy and JAX) and compare them to the approaches present in PyTorch. We will still have a meeting to decide the topics that will be covered in each class. We will put everything in a repository on GitHub to allow other people to use the materials developed for the course as input. In the future, we are thinking of adapting this course for undergraduate studies. What do you think you can't miss in this course? Which topics do you think are extremely important for a good overview of the area? submitted by /u/barash-616 [link] [comments]  ( 103 min )

Yes, you read the title correctly. This is more of a character study/shitpost testing out Stable Diffusion textual inversion to see how to control it / expected outputs. Turns out, it works better than I thought, and emphasizing/deemphasizing specific terms when using textual inversion works out well. The post also includes a custom inference notebook for multiple inversion concepts. submitted by /u/minimaxir [link] [comments]  ( 89 min )

So I read somewhere that we as humans don't understand what exactly happens in a neural network, we just know that a neuron does something using the biases and the inputs given to it and leads us to a specific output. My question here is, do we understand (mathematically speaking) how X input leads the computer to give Y input? If we don't, then why don't we know it? How does a computer go from an array of input pixels to identifying that this is an upside-down dog (mathematically)? submitted by /u/Skrrubs [link] [comments]  ( 112 min )

TorchStudio 0.9.10 was just released with extensions for all the major Python IDEs (VS Code, PyCharm, Spyder and Sublime Text) by popular request, looking forward for your comments ! One new tutorial and two new videos describe how to use TorchStudio from within your IDE. Download: https://www.torchstudio.ai/download/Full changelog: https://github.com/TorchStudio/torchstudio/releases/tag/0.9.10 If you're new to TorchStudio, here's an introductory tutorial and video: https://www.torchstudio.ai/getstarted/ https://www.youtube.com/watch?v=uvA-ARpKdCA https://preview.redd.it/21tufwslnto91.png?width=3074&format=png&auto=webp&s=802b954254f44b5a737070b300c029457fe58962 submitted by /u/divideconcept [link] [comments]  ( 89 min )

I am struggling to understand the nitty gritty of the diffusion models - what would be the right resource to understand all the maths behind it? submitted by /u/throwaway_reddevil9 [link] [comments]  ( 89 min )

Video: https://youtu.be/xbxe-x6wvRw Yannic Kilcher's summary: Stable Diffusion has been released and is riding a wave of creativity and collaboration. But not everyone is happy about this. This video takes a look at the vibrant open-source community around the model, and its critics. Watch here: https://youtu.be/xbxe-x6wvRw submitted by /u/wei_jok [link] [comments]  ( 91 min )

Hello everyone, I am confronted with a machine learning task where the potential for feature engineering is very large, but so is the space of possible models - which means that it's impossible to try out everything. Do you have a fixed model development workflow for this kind of situation? Do you first do feature engineering on some restricted models, and then move on to do model selection? I am looking something similar to this blog-post (which is a work-flow to train neural networks): A Recipe for Training Neural Networks Thanks for your help! submitted by /u/is_it_learning_yet [link] [comments]  ( 90 min )

Hello, I submitted my first paper to AAAI and phase 1 notification is expected on Sep 27. I'm optimistic, but I keep hearing about lots of noise in the review process. ICLR abstract submission is Sep 21 and the final paper submission is Sep 28. So, can one submit an abstract to ICLR pending AAAI phase 1 notification? That is, can you submit an abstract to ICLR, then withdraw in case of accept and submit in case of reject? Thanks submitted by /u/gideon321 [link] [comments]  ( 88 min )

submitted by /u/hardmaru [link] [comments]  ( 88 min )

Hi everyone I've recently dived into ViTs, and a thought crossed my mind that I was surprised to not find many papers exploring. Special tokens are pretty common in transformer architectures, but they usually play a background role, such as structural (like [BEG], [END], [SEP]) or a placeholder of sorts ([CLS], [MASK]). But I feel like self-attention allows for far more intricate constructs, and theoretically one can create a whole "mini-language" to somehow influence model's behaviour. Is there a particular reason it wouldn't work? Are there any papers that do something similar? The only thing I've found is the recently published DyTox, but it just uses single task tokens for task selection. Also there are the Image+Text models like CoCa that just combine the patches with actual natural language, but I'm interested in something more focused. Here's a toy example that works pretty well: Input: an image of 6 EMNIST characters in a row a left/right direction token an argument token denoting one of the characters in the image e.g. "here's an image depicting 'A 5 H Z T 4', which character is to the left of Z?" Output: The character class of the answer, e.g. "H" in this example Here you can essentially create a domain-specific language out of learnable direction and argument tokens alongside the usual ViT patch embeddings, and it works pretty well, even generalizing to neighboring pairs that it haven't seen in the training dataset (something that didn't work well with "dumber" models). Is there just no popular usecase for something like this? submitted by /u/McAvagr [link] [comments]  ( 89 min )

I'm trying to do an excersive for my ML class, where I have to do lineal regresion with regularization, with either Lasso or Ridge. Doing it with an iterative method, updating the weights, I have no idea how to actually do it. Considering this are the augmented error measurements for Lasso and Ridge, I know I have to calculate the gradient, and (I think?) then the update rule becomes: w_new = w_old - (gradient of E_aug). But I'm not actually sure, and even more so, I wouldn't know how to compute the gradient itself, especially for Lasso. submitted by /u/JavoUruguayo [link] [comments]  ( 89 min )

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Hello, ​ Could someone suggest me a good link that has DQN code for Cartpole, using the Keras API. I just spent the entire day looking for codes and most have some sort of bugs. ​ The most common bug I find is, that they confuse DQN and DDQN, by just implementing the target network for the latter. submitted by /u/Academic-Rent7800 [link] [comments]  ( 108 min )

I'm trying to train a DQN Agent to play a (not very) simple game. I'm still new to RL but I have some experience with ML and programming in general so I'm trying to come up with different methods to improve the training time of my model that do not necessarily affect the model itself but also the data representation and the training process itself. The game is simple because generally there are "obvious" optimal states that the agent should try to get to. This gave me an idea to try and start with those obvious and easy states so that the agent can quickly learn that those states can lead to a high rewards. I would then gradually, over many episodes, "increase the difficulty" and let the agent figure how to get to those states. submitted by /u/Gonumen [link] [comments]  ( 105 min )

submitted by /u/gwern [link] [comments]  ( 87 min )

What are some last year examples of the most advanced insights on the Turing Test area? submitted by /u/aladoconpapas [link] [comments]  ( 91 min )

submitted by /u/gvij [link] [comments]  ( 87 min )

All the mainstream once’s (Siri, Alexa,google home) feel much more like rule based chatbots. I was hoping there was something that felt more natural? Has anyone tried mycroft? submitted by /u/Kinghonk69 [link] [comments]  ( 87 min )

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Hello, Stable Diffusion is a great text to image alternative to DALL-E 2 and MidJourney. But if you are a beginner you will quickly realize that creating the right request to generate great images is not necessarily easy. In general, such requests are quite intuitive, but for the most advanced results you might need to use a couple of tricks. Which is why I wrote this quick guide: https://nlpcloud.com/effectively-using-text-to-image-with-stable-diffusion-dalle-2-alternative.html I hope it will be useful! And if you are aware of some nice techniques that are missing in this article, please let me know! Julien submitted by /u/juliensalinas [link] [comments]  ( 87 min )

The title says it. I left the Stable diffusion subreddit because everyone posted mildly but mostly not so interesting AI-generated images. Seeing this subreddit start to receive lots of these as crossposts. submitted by /u/jetstros [link] [comments]  ( 90 min )

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Is there any AI model that does this? submitted by /u/Xie_Bot [link] [comments]  ( 87 min )

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The ISO 3166-1 standard defines three codes for each country: a 2-letter abbreviation, a 3-letter abbreviation, and a 3-digit code. The 2-letter abbreviations may be familiar because it is very often (but not always [1]) also the country code top-level domain (ccTLD). For example, AU is the ISO abbreviation for Australia, and .au is the […] Two-letter vs Three-letter Country Abbreviations first appeared on John D. Cook.  ( 5 min )

A week ago I posted some pairs of similar flags on Twitter, and later I found that Mathematica’s CountryData database contains flag descriptions. So I thought I’d use the flag descriptions to see which flags Mathematica things are similar. For example, the FlagDescription attribute for Chad in Mathematica is Three equal vertical bands of blue […] Finding similar world flags with Mathematica first appeared on John D. Cook.  ( 5 min )

Last year, we announced the general availability of RStudio on Amazon SageMaker, the industry’s first fully managed RStudio Workbench integrated development environment (IDE) in the cloud. You can quickly launch the familiar RStudio IDE, and dial up and down the underlying compute resources without interrupting your work, making it easy to build machine learning (ML) […]  ( 7 min )

As AI becomes more deeply integrated into every aspect of our lives, it is essential that AI systems perform appropriately for their intended use. We know AI models can never be perfect, so how do we decide when AI performance is ‘good enough’ for use in a real life application? Is level of accuracy a […] The post AI Models vs. AI Systems: Understanding Units of Performance Assessment appeared first on Microsoft Research.  ( 12 min )

There have been startups that have survived, and there have been startups that have failed. However, what makes one startup succeed over…  ( 10 min )

To regulate the distribution shift experience by learning-based controllers, we seek a mechanism for constraining the agent to regions of high data density throughout its trajectory (left). Here, we present an approach which achieves this goal by combining features of density models (middle) and Lyapunov functions (right). In order to make use of machine learning and reinforcement learning in controlling real world systems, we must design algorithms which not only achieve good performance, but also interact with the system in a safe and reliable manner. Most prior work on safety-critical control focuses on maintaining the safety of the physical system, e.g. avoiding falling over for legged robots, or colliding into obstacles for autonomous vehicles. However, for learning-based controlle…  ( 7 min )

Training deep neural networks often forces users to work in a distributed or outsourced setting, accompanied with privacy concerns. Split learning aims to address this concern by distributing the model among a client and a server. The scheme supposedly provides privacy, since the server cannot see the clients' models and inputs. We show that this is not true via two novel attacks. (1) We show that an honest-but-curious split learning server, equipped only with the knowledge of the client neural network architecture, can recover the input samples and obtain a functionally similar model to the client model, without being detected. (2) We show that if the client keeps hidden only the output layer of the model to "protect" the private labels, the honest-but-curious server can infer the labels with perfect accuracy. We test our attacks using various benchmark datasets and against proposed privacy-enhancing extensions to split learning. Our results show that plaintext split learning can pose serious risks, ranging from data (input) privacy to intellectual property (model parameters), and provide no more than a false sense of security.

In this paper, we investigate properties and performance of synthetic random graph models with a built-in community structure. Such models are important for evaluating and tuning community detection algorithms that are unsupervised by nature. We propose ABCDe, a multi-threaded implementation of the ABCD (Artificial Benchmark for Community Detection) graph generator. We discuss the implementation details of the algorithm and compare it with both the previously available sequential version of the ABCD model and with the parallel implementation of the standard and extensively used LFR (Lancichinetti--Fortunato--Radicchi) generator. We show that ABCDe is more than ten times faster and scales better than the parallel implementation of LFR provided in NetworKit. Moreover, the algorithm is not only faster but random graphs generated by ABCD have similar properties to the ones generated by the original LFR algorithm, while the parallelized NetworKit implementation of LFR produces graphs that have noticeably different characteristics.

Recently, Deep Neural Networks (DNNs) have been widely introduced into Collaborative Filtering (CF) to produce more accurate recommendation results due to their capability of capturing the complex nonlinear relationships between items and users.However, the DNNs-based models usually suffer from high computational complexity, i.e., consuming very long training time and storing huge amount of trainable parameters. To address these problems, we propose a new broad recommender system called Broad Collaborative Filtering (BroadCF), which is an efficient nonlinear collaborative filtering approach. Instead of DNNs, Broad Learning System (BLS) is used as a mapping function to learn the complex nonlinear relationships between users and items, which can avoid the above issues while achieving very satisfactory recommendation performance. However, it is not feasible to directly feed the original rating data into BLS. To this end, we propose a user-item rating collaborative vector preprocessing procedure to generate low-dimensional user-item input data, which is able to harness quality judgments of the most similar users/items. Extensive experiments conducted on seven benchmark datasets have confirmed the effectiveness of the proposed BroadCF algorithm

Neural tangent kernel (NTK) is a powerful tool to analyze training dynamics of neural networks and their generalization bounds. The study on NTK has been devoted to typical neural network architectures, but is incomplete for neural networks with Hadamard products (NNs-Hp), e.g., StyleGAN and polynomial neural networks. In this work, we derive the finite-width NTK formulation for a special class of NNs-Hp, i.e., polynomial neural networks. We prove their equivalence to the kernel regression predictor with the associated NTK, which expands the application scope of NTK. Based on our results, we elucidate the separation of PNNs over standard neural networks with respect to extrapolation and spectral bias. Our two key insights are that when compared to standard neural networks, PNNs are able to fit more complicated functions in the extrapolation regime and admit a slower eigenvalue decay of the respective NTK. Besides, our theoretical results can be extended to other types of NNs-Hp, which expand the scope of our work. Our empirical results validate the separations in broader classes of NNs-Hp, which provide a good justification for a deeper understanding of neural architectures.

Variational Autoencoders (VAEs) have recently been highly successful at imputing and acquiring heterogeneous missing data. However, within this specific application domain, existing VAE methods are restricted by using only one layer of latent variables and strictly Gaussian posterior approximations. To address these limitations, we present HH-VAEM, a Hierarchical VAE model for mixed-type incomplete data that uses Hamiltonian Monte Carlo with automatic hyper-parameter tuning for improved approximate inference. Our experiments show that HH-VAEM outperforms existing baselines in the tasks of missing data imputation and supervised learning with missing features. Finally, we also present a sampling-based approach for efficiently computing the information gain when missing features are to be acquired with HH-VAEM. Our experiments show that this sampling-based approach is superior to alternatives based on Gaussian approximations.

Functional Electrical Stimulation (FES) is a technique to evoke muscle contraction through low-energy electrical signals. FES can animate paralysed limbs. Yet, an open challenge remains on how to apply FES to achieve desired movements. This challenge is accentuated by the complexities of human bodies and the non-stationarities of the muscles' responses. The former causes difficulties in performing inverse dynamics, and the latter causes control performance to degrade over extended periods of use. Here, we engage the challenge via a data-driven approach. Specifically, we learn to control FES through Reinforcement Learning (RL) which can automatically customise the stimulation for the patients. However, RL typically has Markovian assumptions while FES control systems are non-Markovian because of the non-stationarities. To deal with this problem, we use a recurrent neural network to create Markovian state representations. We cast FES controls into RL problems and train RL agents to control FES in different settings in both simulations and the real world. The results show that our RL controllers can maintain control performances over long periods and have better stimulation characteristics than PID controllers.

5G cellular systems depend on the timely exchange of feedback control information between the user equipment and the base station. Proper decoding of this control information is necessary to set up and sustain high throughput radio links. This paper makes the first attempt at using Machine Learning techniques to improve the decoding performance of the Physical Uplink Control Channel Format 0. We use fully connected neural networks to classify the received samples based on the uplink control information content embedded within them. The trained neural network, tested on real-time wireless captures, shows significant improvement in accuracy over conventional DFT-based decoders, even at low SNR. The obtained accuracy results also demonstrate conformance with 3GPP requirements.

In this paper, we propose a new zero order optimization method called minibatch stochastic three points (MiSTP) method to solve an unconstrained minimization problem in a setting where only an approximation of the objective function evaluation is possible. It is based on the recently proposed stochastic three points (STP) method (Bergou et al., 2020). At each iteration, MiSTP generates a random search direction in a similar manner to STP, but chooses the next iterate based solely on the approximation of the objective function rather than its exact evaluations. We also analyze our method's complexity in the nonconvex and convex cases and evaluate its performance on multiple machine learning tasks.

In recent years, the power demonstrated by Machine Learning (ML) has increasingly attracted the interest of the optimization community that is starting to leverage ML for enhancing and automating the design of algorithms. One combinatorial optimization problem recently tackled with ML is the Job Shop scheduling Problem (JSP). Most of the works on the JSP using ML focus on Deep Reinforcement Learning (DRL), and only a few of them leverage supervised learning techniques. The recurrent reasons for avoiding supervised learning seem to be the difficulty in casting the right learning task, i.e., what is meaningful to predict, and how to obtain labels. Therefore, we first propose a novel supervised learning task that aims at predicting the quality of machine permutations. Then, we design an original methodology to estimate this quality, and we use these estimations to create an accurate sequential deep learning model (binary accuracy above 95%). Finally, we empirically demonstrate the value of predicting the quality of machine permutations by enhancing the performance of a simple Tabu Search algorithm inspired by the works in the literature.

We apply methods of machine-learning, such as neural networks, manifold learning and image processing, in order to study 2-dimensional amoebae in algebraic geometry and string theory. With the help of embedding manifold projection, we recover complicated conditions obtained from so-called lopsidedness. For certain cases it could even reach $\sim99\%$ accuracy, in particular for the lopsided amoeba of $F_0$ with positive coefficients which we place primary focus. Using weights and biases, we also find good approximations to determine the genus for an amoeba at lower computational cost. In general, the models could easily predict the genus with over $90\%$ accuracies. With similar techniques, we also investigate the membership problem, and image processing of the amoebae directly.

We present an effective GNN-based knowledge graph embedding model, named WGE, to capture entity- and relation-focused graph structures. In particular, given the knowledge graph, WGE builds a single undirected entity-focused graph that views entities as nodes. In addition, WGE also constructs another single undirected graph from relation-focused constraints, which views entities and relations as nodes. WGE then proposes a GNN-based architecture to better learn vector representations of entities and relations from these two single entity- and relation-focused graphs. WGE feeds the learned entity and relation representations into a weighted score function to return the triple scores for knowledge graph completion. Experimental results show that WGE outperforms competitive baselines, obtaining state-of-the-art performances on seven benchmark datasets for knowledge graph completion.

We study the asymmetric matrix factorization problem under a natural nonconvex formulation with arbitrary overparametrization. The model-free setting is considered, with minimal assumption on the rank or singular values of the observed matrix, where the global optima provably overfit. We show that vanilla gradient descent with small random initialization sequentially recovers the principal components of the observed matrix. Consequently, when equipped with proper early stopping, gradient descent produces the best low-rank approximation of the observed matrix without explicit regularization. We provide a sharp characterization of the relationship between the approximation error, iteration complexity, initialization size and stepsize. Our complexity bound is almost dimension-free and depends logarithmically on the approximation error, with significantly more lenient requirements on the stepsize and initialization compared to prior work. Our theoretical results provide accurate prediction for the behavior gradient descent, showing good agreement with numerical experiments.

Training models on data obtained from randomized experiments is ideal for making good decisions. However, randomized experiments are often time-consuming, expensive, risky, infeasible or unethical to perform, leaving decision makers little choice but to rely on observational data collected under historical policies when training models. This opens questions regarding not only which decision-making policies would perform best in practice, but also regarding the impact of different data collection protocols on the performance of various policies trained on the data, or the robustness of policy performance with respect to changes in problem characteristics such as action- or reward- specific delays in observing outcomes. We aim to answer such questions for the problem of optimizing sales channel allocations at LinkedIn, where sales accounts (leads) need to be allocated to one of three channels, with the goal of maximizing the number of successful conversions over a period of time. A key problem feature constitutes the presence of stochastic delays in observing allocation outcomes, whose distribution is both channel- and outcome- dependent. We built a discrete-time simulation that can handle our problem features and used it to evaluate: a) a historical rule-based policy; b) a supervised machine learning policy (XGBoost); and c) multi-armed bandit (MAB) policies, under different scenarios involving: i) data collection used for training (observational vs randomized); ii) lead conversion scenarios; iii) delay distributions. Our simulation results indicate that LinUCB, a simple MAB policy, consistently outperforms the other policies, achieving a 18-47% lift relative to a rule-based policy

Large pre-trained language models are successfully being used in a variety of tasks, across many languages. With this ever-increasing usage, the risk of harmful side effects also rises, for example by reproducing and reinforcing stereotypes. However, detecting and mitigating these harms is difficult to do in general and becomes computationally expensive when tackling multiple languages or when considering different biases. To address this, we present FairDistillation: a cross-lingual method based on knowledge distillation to construct smaller language models while controlling for specific biases. We found that our distillation method does not negatively affect the downstream performance on most tasks and successfully mitigates stereotyping and representational harms. We demonstrate that FairDistillation can create fairer language models at a considerably lower cost than alternative approaches.

Multi-task learning (MTL) jointly learns a set of tasks by sharing parameters among tasks. It is a promising approach for reducing storage costs while improving task accuracy for many computer vision tasks. The effective adoption of MTL faces two main challenges. The first challenge is to determine what parameters to share across tasks to optimize for both memory efficiency and task accuracy. The second challenge is to automatically apply MTL algorithms to an arbitrary CNN backbone without requiring time-consuming manual re-implementation and significant domain expertise. This paper addresses the challenges by developing the first programming framework AutoMTL that automates efficient MTL model development for vision tasks. AutoMTL takes as inputs an arbitrary backbone convolutional neural network (CNN) and a set of tasks to learn, and automatically produces a multi-task model that achieves high accuracy and small memory footprint simultaneously. Experiments on three popular MTL benchmarks (CityScapes, NYUv2, Tiny-Taskonomy) demonstrate the effectiveness of AutoMTL over state-of-the-art approaches as well as the generalizability of AutoMTL across CNNs. AutoMTL is open-sourced and available at https://github.com/zhanglijun95/AutoMTL.

In order to replace fossil fuels with the use of renewable energy resources, unbalanced resource production of intermittent wind and photovoltaic (PV) power is a critical issue for peer-to-peer (P2P) power trading. To resolve this problem, a reinforcement learning (RL) technique is introduced in this paper. For RL, graph convolutional network (GCN) and bi-directional long short-term memory (Bi-LSTM) network are jointly applied to P2P power trading between nanogrid clusters based on cooperative game theory. The flexible and reliable DC nanogrid is suitable to integrate renewable energy for distribution system. Each local nanogrid cluster takes the position of prosumer, focusing on power production and consumption simultaneously. For the power management of nanogrid clusters, multi-objective optimization is applied to each local nanogrid cluster with the Internet of Things (IoT) technology. Charging/discharging of electric vehicle (EV) is performed considering the intermittent characteristics of wind and PV power production. RL algorithms, such as deep Q-learning network (DQN), deep recurrent Q-learning network (DRQN), Bi-DRQN, proximal policy optimization (PPO), GCN-DQN, GCN-DRQN, GCN-Bi-DRQN, and GCN-PPO, are used for simulations. Consequently, the cooperative P2P power trading system maximizes the profit utilizing the time of use (ToU) tariff-based electricity cost and system marginal price (SMP), and minimizes the amount of grid power consumption. Power management of nanogrid clusters with P2P power trading is simulated on the distribution test feeder in real-time and proposed GCN-PPO technique reduces the electricity cost of nanogrid clusters by 36.7%.

Datasets with significant proportions of bias present threats for training a trustworthy model on NLU tasks. Despite yielding great progress, current debiasing methods impose excessive reliance on the knowledge of bias attributes. Definition of the attributes, however, is elusive and varies across different datasets. Furthermore, leveraging these attributes at input level to bias mitigation may leave a gap between intrinsic properties and the underlying decision rule. To narrow down this gap and liberate the supervision on bias, we suggest extending bias mitigation into feature space. Therefore, a novel model, Recovering Intended-Feature Subspace with Knowledge-Free (RISK) is developed. Assuming that shortcut features caused by various biases are unintended for prediction, RISK views them as redundant features. When delving into a lower manifold to remove redundancies, RISK reveals that an extremely low-dimensional subspace with intended features can robustly represent the highly biased dataset. Empirical results demonstrate our model can consistently improve model generalization to out-of-distribution set, and achieves a new state-of-the-art performance.  ( 2 min )

Exploration is a fundamental challenge in Deep Reinforcement Learning (DRL) based model-free navigation control since typical exploration techniques for target-driven navigation tasks rely on noise or greedy policies, which are sensitive to the density of rewards. In practice, robots are always deployed in complex cluttered environments, containing dense obstacles and narrow passageways, raising natural spare rewards that are hard to be explored for training. Such a problem becomes even more serious when pre-defined tasks are complex and have rich expressivity. In this paper, we focus on these two aspects and present a deep policy gradient algorithm for a task-guided robot with unknown dynamic systems deployed in a complex cluttered environment. Linear Temporal Logic (LTL) is applied to express a rich robotic specification. To overcome the environmental challenge of exploration during training, we propose a novel path planning-guided reward scheme that is dense over the state space, and crucially, robust to the infeasibility of computed geometric paths due to the black-box dynamics. To facilitate LTL satisfaction, our approach decomposes the LTL mission into sub-tasks that are solved using distributed DRL, where the sub-tasks can be trained in parallel, using Deep Policy Gradient algorithms. Our framework is shown to significantly improve performance (effectiveness, efficiency) and exploration of robots tasked with complex missions in large-scale complex environments. The Video demo can be found on YouTube Channel: https://youtu.be/YQRQ2-yMtIk.

Unsupervised domain adaptation (UDA) has been a vital protocol for migrating information learned from a labeled source domain to facilitate the implementation in an unlabeled heterogeneous target domain. Although UDA is typically jointly trained on data from both domains, accessing the labeled source domain data is often restricted, due to concerns over patient data privacy or intellectual property. To sidestep this, we propose "off-the-shelf (OS)" UDA (OSUDA), aimed at image segmentation, by adapting an OS segmentor trained in a source domain to a target domain, in the absence of source domain data in adaptation. Toward this goal, we aim to develop a novel batch-wise normalization (BN) statistics adaptation framework. In particular, we gradually adapt the domain-specific low-order BN statistics, e.g., mean and variance, through an exponential momentum decay strategy, while explicitly enforcing the consistency of the domain shareable high-order BN statistics, e.g., scaling and shifting factors, via our optimization objective. We also adaptively quantify the channel-wise transferability to gauge the importance of each channel, via both low-order statistics divergence and a scaling factor.~Furthermore, we incorporate unsupervised self-entropy minimization into our framework to boost performance alongside a novel queued, memory-consistent self-training strategy to utilize the reliable pseudo label for stable and efficient unsupervised adaptation. We evaluated our OSUDA-based framework on both cross-modality and cross-subtype brain tumor segmentation and cardiac MR to CT segmentation tasks. Our experimental results showed that our memory consistent OSUDA performs better than existing source-relaxed UDA methods and yields similar performance to UDA methods with source data.

Recently, Graph Neural Networks (GNNs) have significantly advanced the performance of machine learning tasks on graphs. However, this technological breakthrough makes people wonder: how does a GNN make such decisions, and can we trust its prediction with high confidence? When it comes to some critical fields such as biomedicine, where making wrong decisions can have severe consequences, interpreting the inner working mechanisms of GNNs before applying them is crucial. In this paper, we propose a novel model-agnostic model-level explanation method for different GNNs that follow the message passing scheme, GNNInterpreter, to explain the high-level decision-making process of the GNN model. More specifically, with continuous relaxation of graphs and the reparameterization trick, GNNInterpreter learns a probabilistic generative graph distribution which produces the most representative graph for the target prediction in the eye of the GNN model. Compared with the only existing work, GNNInterpreter is more computationally efficient and more flexible in generating explanation graphs with different types of node features and edge features, without introducing another blackbox to explain the GNN and without requiring domain-specific knowledge. Additionally, the experimental studies conducted on four different datasets demonstrate that the explanation graph generated by GNNInterpreter can match the desired graph pattern when the model is ideal and reveal potential model pitfalls if there exist any.

Learning diverse skills is one of the main challenges in robotics. To this end, imitation learning approaches have achieved impressive results. These methods require explicitly labeled datasets or assume consistent skill execution to enable learning and active control of individual behaviors, which limits their applicability. In this work, we propose a cooperative adversarial method for obtaining single versatile policies with controllable skill sets from unlabeled datasets containing diverse state transition patterns by maximizing their discriminability. Moreover, we show that by utilizing unsupervised skill discovery in the generative adversarial imitation learning framework, novel and useful skills emerge with successful task fulfillment. Finally, the obtained versatile policies are tested on an agile quadruped robot called Solo 8 and present faithful replications of diverse skills encoded in the demonstrations.  ( 2 min )

We study a sequential decision problem where the learner faces a sequence of $K$-armed stochastic bandit tasks. An adversary may design the tasks, but the adversary is constrained to choose the optimal arm of each task in a smaller (but unknown) subset of $M$ arms. The task boundaries might be known (the bandit meta-learning setting), or unknown (the non-stationary bandit setting). We design an algorithm based on a reduction to bandit submodular maximization and show that, in the regime of large number of tasks and small number of optimal arms, its regret in both settings is smaller than the simple baseline of $\tilde{O}(\sqrt{KNT})$ that can be obtained by using standard algorithms designed for non-stationary bandit problems. For the bandit meta-learning problem with fixed task length $\tau$, we show that the regret of the algorithm is bounded as $\tilde{O}(NM\sqrt{M \tau}+N^{2/3}M\tau)$. Under additional assumptions on the identifiability of the optimal arms in each task, we show a bandit meta-learning algorithm with an improved $\tilde{O}(N\sqrt{M \tau}+N^{1/2}\sqrt{M K \tau})$ regret.  ( 3 min )

Learning a single static convolutional kernel in each convolutional layer is the common training paradigm of modern Convolutional Neural Networks (CNNs). Instead, recent research in dynamic convolution shows that learning a linear combination of $n$ convolutional kernels weighted with their input-dependent attentions can significantly improve the accuracy of light-weight CNNs, while maintaining efficient inference. However, we observe that existing works endow convolutional kernels with the dynamic property through one dimension (regarding the convolutional kernel number) of the kernel space, but the other three dimensions (regarding the spatial size, the input channel number and the output channel number for each convolutional kernel) are overlooked. Inspired by this, we present Omni-dimensional Dynamic Convolution (ODConv), a more generalized yet elegant dynamic convolution design, to advance this line of research. ODConv leverages a novel multi-dimensional attention mechanism with a parallel strategy to learn complementary attentions for convolutional kernels along all four dimensions of the kernel space at any convolutional layer. As a drop-in replacement of regular convolutions, ODConv can be plugged into many CNN architectures. Extensive experiments on the ImageNet and MS-COCO datasets show that ODConv brings solid accuracy boosts for various prevailing CNN backbones including both light-weight and large ones, e.g., 3.77%~5.71%|1.86%~3.72% absolute top-1 improvements to MobivleNetV2|ResNet family on the ImageNet dataset. Intriguingly, thanks to its improved feature learning ability, ODConv with even one single kernel can compete with or outperform existing dynamic convolution counterparts with multiple kernels, substantially reducing extra parameters. Furthermore, ODConv is also superior to other attention modules for modulating the output features or the convolutional weights.

Graph contrastive learning (GCL) is prevalent to tackle the supervision shortage issue in graph learning tasks. Many recent GCL methods have been proposed with various manually designed augmentation techniques, aiming to implement challenging augmentations on the original graph to yield robust representation. Although many of them achieve remarkable performances, existing GCL methods still struggle to improve model robustness without risking losing task-relevant information because they ignore the fact the augmentation-induced latent factors could be highly entangled with the original graph, thus it is more difficult to discriminate the task-relevant information from irrelevant information. Consequently, the learned representation is either brittle or unilluminating. In light of this, we introduce the Adversarial Cross-View Disentangled Graph Contrastive Learning (ACDGCL), which follows the information bottleneck principle to learn minimal yet sufficient representations from graph data. To be specific, our proposed model elicits the augmentation-invariant and augmentation-dependent factors separately. Except for the conventional contrastive loss which guarantees the consistency and sufficiency of the representations across different contrastive views, we introduce a cross-view reconstruction mechanism to pursue the representation disentanglement. Besides, an adversarial view is added as the third view of contrastive loss to enhance model robustness. We empirically demonstrate that our proposed model outperforms the state-of-the-arts on graph classification task over multiple benchmark datasets.

In this paper, we consider decentralized optimization problems where agents have individual cost functions to minimize subject to subspace constraints that require the minimizers across the network to lie in low-dimensional subspaces. This constrained formulation includes consensus or single-task optimization as special cases, and allows for more general task relatedness models such as multitask smoothness and coupled optimization. In order to cope with communication constraints, we propose and study an adaptive decentralized strategy where the agents employ differential randomized quantizers to compress their estimates before communicating with their neighbors. The analysis shows that, under some general conditions on the quantization noise, and for sufficiently small step-sizes $\mu$, the strategy is stable both in terms of mean-square error and average bit rate: by reducing $\mu$, it is possible to keep the estimation errors small (on the order of $\mu$) without increasing indefinitely the bit rate as $\mu\rightarrow 0$. Simulations illustrate the theoretical findings and the effectiveness of the proposed approach, revealing that decentralized learning is achievable at the expense of only a few bits.  ( 2 min )

With the wide spread of sensors and smart devices in recent years, the data generation speed of the Internet of Things (IoT) systems has increased dramatically. In IoT systems, massive volumes of data must be processed, transformed, and analyzed on a frequent basis to enable various IoT services and functionalities. Machine Learning (ML) approaches have shown their capacity for IoT data analytics. However, applying ML models to IoT data analytics tasks still faces many difficulties and challenges, specifically, effective model selection, design/tuning, and updating, which have brought massive demand for experienced data scientists. Additionally, the dynamic nature of IoT data may introduce concept drift issues, causing model performance degradation. To reduce human efforts, Automated Machine Learning (AutoML) has become a popular field that aims to automatically select, construct, tune, and update machine learning models to achieve the best performance on specified tasks. In this paper, we conduct a review of existing methods in the model selection, tuning, and updating procedures in the area of AutoML in order to identify and summarize the optimal solutions for every step of applying ML algorithms to IoT data analytics. To justify our findings and help industrial users and researchers better implement AutoML approaches, a case study of applying AutoML to IoT anomaly detection problems is conducted in this work. Lastly, we discuss and classify the challenges and research directions for this domain.  ( 3 min )

The COVID-19 pandemic has posed a heavy burden to the healthcare system worldwide and caused huge social disruption and economic loss. Many deep learning models have been proposed to conduct clinical predictive tasks such as mortality prediction for COVID-19 patients in intensive care units using Electronic Health Record (EHR) data. Despite their initial success in certain clinical applications, there is currently a lack of benchmarking results to achieve a fair comparison so that we can select the optimal model for clinical use. Furthermore, there is a discrepancy between the formulation of traditional prediction tasks and real-world clinical practice in intensive care. To fill these gaps, we propose two clinical prediction tasks, Outcome-specific length-of-stay prediction and Early mortality prediction for COVID-19 patients in intensive care units. The two tasks are adapted from the naive length-of-stay and mortality prediction tasks to accommodate the clinical practice for COVID-19 patients. We propose fair, detailed, open-source data-preprocessing pipelines and evaluate 17 state-of-the-art predictive models on two tasks, including 5 machine learning models, 6 basic deep learning models and 6 deep learning predictive models specifically designed for EHR data. We provide benchmarking results using data from two real-world COVID-19 EHR datasets. Both datasets are publicly available without needing any inquiry and one dataset can be accessed on request. We provide fair, reproducible benchmarking results for two tasks. We deploy all experiment results and models on an online platform. We also allow clinicians and researchers to upload their data to the platform and get quick prediction results using our trained models. We hope our efforts can further facilitate deep learning and machine learning research for COVID-19 predictive modeling.  ( 3 min )

Many data mining tasks rely on graphs to model relational structures among individuals (nodes). Since relational data are often sensitive, there is an urgent need to evaluate the privacy risks in graph data. One famous privacy attack against data analysis models is the model inversion attack, which aims to infer sensitive data in the training dataset and leads to great privacy concerns. Despite its success in grid-like domains, directly applying model inversion attacks on non-grid domains such as graph leads to poor attack performance. This is mainly due to the failure to consider the unique properties of graphs. To bridge this gap, we conduct a systematic study on model inversion attacks against Graph Neural Networks (GNNs), one of the state-of-the-art graph analysis tools in this paper. Firstly, in the white-box setting where the attacker has full access to the target GNN model, we present GraphMI to infer the private training graph data. Specifically, in GraphMI, a projected gradient module is proposed to tackle the discreteness of graph edges and preserve the sparsity and smoothness of graph features; a graph auto-encoder module is used to efficiently exploit graph topology, node attributes, and target model parameters for edge inference; a random sampling module can finally sample discrete edges. Furthermore, in the hard-label black-box setting where the attacker can only query the GNN API and receive the classification results, we propose two methods based on gradient estimation and reinforcement learning (RL-GraphMI). Our experimental results show that such defenses are not sufficiently effective and call for more advanced defenses against privacy attacks.  ( 3 min )

The medial temporal lobe (MTL), a brain region containing the hippocampus and nearby areas, is hypothesized to be an experience-construction system in mammals, supporting both recall and imagination of temporally-extended sequences of events. Such capabilities are also core to many recently proposed ``world models" in the field of AI research. Taking inspiration from this connection, we propose a novel variant, the Dual Stream World Model (DSWM), which learns from high-dimensional observations and dissociates them into context and content streams. DSWM can reliably generate imagined trajectories in novel 2D environments after only a single exposure, outperforming a standard world model. DSWM also learns latent representations which bear a strong resemblance to place cells found in the hippocampus. We show that this representation is useful as a reinforcement learning basis function, and that the generative model can be used to aid the policy learning process using Dyna-like updates.  ( 2 min )

Context: The identification of bugs within the reported issues in an issue tracker is crucial for the triage of issues. Machine learning models have shown promising results regarding the performance of automated issue type prediction. However, we have only limited knowledge beyond our assumptions how such models identify bugs. LIME and SHAP are popular technique to explain the predictions of classifiers. Objective: We want to understand if machine learning models provide explanations for the classification that are reasonable to us as humans and align with our assumptions of what the models should learn. We also want to know if the prediction quality is correlated with the quality of explanations. Method: We conduct a study where we rate LIME and SHAP explanations based on their quality of explaining the outcome of an issue type prediction model. For this, we rate the quality of the explanations themselves, i.e., if they align with our expectations and if they help us to understand the underlying machine learning model.  ( 2 min )

Smartwatches or fitness trackers have garnered a lot of popularity as potential health tracking devices due to their affordable and longitudinal monitoring capabilities. To further widen their health tracking capabilities, in recent years researchers have started to look into the possibility of Atrial Fibrillation (AF) detection in real-time leveraging photoplethysmography (PPG) data, an inexpensive sensor widely available in almost all smartwatches. A significant challenge in AF detection from PPG signals comes from the inherent noise in the smartwatch PPG signals. In this paper, we propose a novel deep learning based approach, BayesBeat that leverages the power of Bayesian deep learning to accurately infer AF risks from noisy PPG signals, and at the same time provides an uncertainty estimate of the prediction. Extensive experiments on two publicly available dataset reveal that our proposed method BayesBeat outperforms the existing state-of-the-art methods. Moreover, BayesBeat is substantially more efficient having 40-200X fewer parameters than state-of-the-art baseline approaches making it suitable for deployment in resource constrained wearable devices.  ( 3 min )

While graph neural networks (GNNs) have been successful for node classification tasks and link prediction tasks in graph, learning graph-level representations still remains a challenge. For the graph-level representation, it is important to learn both representation of neighboring nodes, i.e., aggregation, and graph structural information. A number of graph pooling methods have been developed for this goal. However, most of the existing pooling methods utilize k-hop neighborhood without considering explicit structural information in a graph. In this paper, we propose Structure Prototype Guided Pooling (SPGP) that utilizes prior graph structures to overcome the limitation. SPGP formulates graph structures as learnable prototype vectors and computes the affinity between nodes and prototype vectors. This leads to a novel node scoring scheme that prioritizes informative nodes while encapsulating the useful structures of the graph. Our experimental results show that SPGP outperforms state-of-the-art graph pooling methods on graph classification benchmark datasets in both accuracy and scalability.  ( 2 min )

Feature transformation aims to extract a good representation (feature) space by mathematically transforming existing features. It is crucial to address the curse of dimensionality, enhance model generalization, overcome data sparsity, and expand the availability of classic models. Current research focuses on domain knowledge-based feature engineering or learning latent representations; nevertheless, these methods are not entirely automated and cannot produce a traceable and optimal representation space. When rebuilding a feature space for a machine learning task, can these limitations be addressed concurrently? In this extension study, we present a self-optimizing framework for feature transformation. To achieve a better performance, we improved the preliminary work by (1) obtaining an advanced state representation for enabling reinforced agents to comprehend the current feature set better; and (2) resolving Q-value overestimation in reinforced agents for learning unbiased and effective policies. Finally, to make experiments more convincing than the preliminary work, we conclude by adding the outlier detection task with five datasets, evaluating various state representation approaches, and comparing different training strategies. Extensive experiments and case studies show that our work is more effective and superior.  ( 2 min )

Log analysis is one of the main techniques engineers use to troubleshoot faults of large-scale software systems. During the past decades, many log analysis approaches have been proposed to detect system anomalies reflected by logs. They usually take log event counts or sequential log events as inputs and utilize machine learning algorithms including deep learning models to detect system anomalies. These anomalies are often identified as violations of quantitative relational patterns or sequential patterns of log events in log sequences. However, existing methods fail to leverage the spatial structural relationships among log events, resulting in potential false alarms and unstable performance. In this study, we propose a novel graph-based log anomaly detection method, LogGD, to effectively address the issue by transforming log sequences into graphs. We exploit the powerful capability of Graph Transformer Neural Network, which combines graph structure and node semantics for log-based anomaly detection. We evaluate the proposed method on four widely-used public log datasets. Experimental results show that LogGD can outperform state-of-the-art quantitative-based and sequence-based methods and achieve stable performance under different window size settings. The results confirm that LogGD is effective in log-based anomaly detection.

Community detection and orthogonal group synchronization are both fundamental problems with a variety of important applications in science and engineering. In this work, we consider the joint problem of community detection and orthogonal group synchronization which aims to recover the communities and perform synchronization simultaneously. To this end, we propose a simple algorithm that consists of a spectral decomposition step followed by a blockwise column pivoted QR factorization (CPQR). The proposed algorithm is efficient and scales linearly with the number of edges in the graph. We also leverage the recently developed `leave-one-out' technique to establish a near-optimal guarantee for exact recovery of the cluster memberships and stable recovery of the orthogonal transforms. Numerical experiments demonstrate the efficiency and efficacy of our algorithm and confirm our theoretical characterization of it.

Efficient custom pooling techniques that can aggressively trim the dimensions of a feature map and thereby reduce inference compute and memory footprint for resource-constrained computer vision applications have recently gained significant traction. However, prior pooling works extract only the local context of the activation maps, limiting their effectiveness. In contrast, we propose a novel non-local self-attentive pooling method that can be used as a drop-in replacement to the standard pooling layers, such as max/average pooling or strided convolution. The proposed self-attention module uses patch embedding, multi-head self-attention, and spatial-channel restoration, followed by sigmoid activation and exponential soft-max. This self-attention mechanism efficiently aggregates dependencies between non-local activation patches during down-sampling. Extensive experiments on standard object classification and detection tasks with various convolutional neural network (CNN) architectures demonstrate the superiority of our proposed mechanism over the state-of-the-art (SOTA) pooling techniques. In particular, we surpass the test accuracy of existing pooling techniques on different variants of MobileNet-V2 on ImageNet by an average of 1.2%. With the aggressive down-sampling of the activation maps in the initial layers (providing up to 22x reduction in memory consumption), our approach achieves 1.43% higher test accuracy compared to SOTA techniques with iso-memory footprints. This enables the deployment of our models in memory-constrained devices, such as micro-controllers (without losing significant accuracy), because the initial activation maps consume a significant amount of on-chip memory for high-resolution images required for complex vision tasks. Our proposed pooling method also leverages the idea of channel pruning to further reduce memory footprints.  ( 3 min )

Continual learning and few-shot learning are important frontiers in the quest to improve Machine Learning. There is a growing body of work in each frontier, but very little combining the two. Recently however, Antoniou et al. arXiv:2004.11967 introduced a Continual Few-shot Learning framework, CFSL, that combines both. In this study, we extended CFSL to make it more comparable to standard continual learning experiments, where usually a much larger number of classes are presented. We also introduced an `instance test' to classify very similar specific instances - a capability of animal cognition that is usually neglected in ML. We selected representative baseline models from the original CFSL work and compared to a model with Hippocampal-inspired replay, as the Hippocampus is considered to be vital to this type of learning in animals. As expected, learning more classes is more difficult than the original CFSL experiments, and interestingly, the way in which they are presented makes a difference to performance. Accuracy in the instance test is comparable to the classification tasks. The use of replay for consolidation improves performance substantially for both types of tasks, particularly the instance test.

Removing background noise from speech audio has been the subject of considerable effort, especially in recent years due to the rise of virtual communication and amateur recordings. Yet background noise is not the only unpleasant disturbance that can prevent intelligibility: reverb, clipping, codec artifacts, problematic equalization, limited bandwidth, or inconsistent loudness are equally disturbing and ubiquitous. In this work, we propose to consider the task of speech enhancement as a holistic endeavor, and present a universal speech enhancement system that tackles 55 different distortions at the same time. Our approach consists of a generative model that employs score-based diffusion, together with a multi-resolution conditioning network that performs enhancement with mixture density networks. We show that this approach significantly outperforms the state of the art in a subjective test performed by expert listeners. We also show that it achieves competitive objective scores with just 4-8 diffusion steps, despite not considering any particular strategy for fast sampling. We hope that both our methodology and technical contributions encourage researchers and practitioners to adopt a universal approach to speech enhancement, possibly framing it as a generative task.

Distributed deep learning frameworks such as split learning provide great benefits with regards to the computational cost of training deep neural networks and the privacy-aware utilization of the collective data of a group of data-holders. Split learning, in particular, achieves this goal by dividing a neural network between a client and a server so that the client computes the initial set of layers, and the server computes the rest. However, this method introduces a unique attack vector for a malicious server attempting to steal the client's private data: the server can direct the client model towards learning any task of its choice, e.g. towards outputting easily invertible values. With a concrete example already proposed (Pasquini et al., CCS '21), such training-hijacking attacks present a significant risk for the data privacy of split learning clients. In this paper, we propose SplitGuard, a method by which a split learning client can detect whether it is being targeted by a training-hijacking attack or not. We experimentally evaluate our method's effectiveness, compare it with potential alternatives, and discuss in detail various points related to its use. We conclude that SplitGuard can effectively detect training-hijacking attacks while minimizing the amount of information recovered by the adversaries.

Data poisoning considers an adversary that distorts the training set of machine learning algorithms for malicious purposes. In this work, we bring to light one conjecture regarding the fundamentals of data poisoning, which we call the Lethal Dose Conjecture. The conjecture states: If $n$ clean training samples are needed for accurate predictions, then in a size-$N$ training set, only $\Theta(N/n)$ poisoned samples can be tolerated while ensuring accuracy. Theoretically, we verify this conjecture in multiple cases. We also offer a more general perspective of this conjecture through distribution discrimination. Deep Partition Aggregation (DPA) and its extension, Finite Aggregation (FA) are recent approaches for provable defenses against data poisoning, where they predict through the majority vote of many base models trained from different subsets of training set using a given learner. The conjecture implies that both DPA and FA are (asymptotically) optimal -- if we have the most data-efficient learner, they can turn it into one of the most robust defenses against data poisoning. This outlines a practical approach to developing stronger defenses against poisoning via finding data-efficient learners. Empirically, as a proof of concept, we show that by simply using different data augmentations for base learners, we can respectively double and triple the certified robustness of DPA on CIFAR-10 and GTSRB without sacrificing accuracy.